Molecule FYI-1006210

A

Molecule Summary:

ID: FYI-1006210
Names:
InChIKey: HUVCVYPXHNLLPX-MIAZNNDBSA-O
SMILES: C/[O+]=C(N[C@@H](CCC(=O)O)C(=O)N[C@@H](CS)C(=O)N[C@H](CCSC)C(=O)O)/[C@H](Cc1ccccc1)NC(=O)[C@H](CCCNC(=N)N(C)C)NC(=O)[C@H](CCC(=O)O)NC(=O)[C@H](CCCNC(=N)N)NC(=O)CN

Received at FYIcenter.com on: 2023-12-02

Molecule ID: FYI-1006210 Edit

Molecule Structure InChIKey: HUVCVYPXHNLLPX-MIAZNNDBSA-O

Molecule Structure SMILES String: C/[O+]=C(N[C@@H](CCC(=O)O)C(=O)N[C@@H](CS)C(=O)N[C@H](CCSC)C(=O)O)/[C@H](Cc1ccccc1)NC(=O)[C@H](CCCNC(=N)N(C)C)NC(=O)[C@H](CCC(=O)O)NC(=O)[C@H](CCCNC(=N)N)NC(=O)CN

Download SDF Download SVG Structure in 2D SDF:

FYI-1006210
FYIcenter.com

 73 73  0  0  1  0  0  0  0  0999 V2000
   24.2487    3.5000    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
   25.4611    4.2000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   25.4611    5.6000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   24.2487    6.3000    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   26.6735    6.3000    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
   26.6735    7.7000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.6373    5.6000    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   27.8860    8.4000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   29.0984    7.7000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   30.3109    8.4000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   31.5233    7.7000    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
   32.7357    8.4000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   33.9482    7.7000    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
   32.7357    9.8000    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
   25.4611    8.4000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   25.4611    9.8000    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   24.2487    7.7000    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
   23.0363    8.4000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    6.0622    5.6000    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   23.0363    9.8000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   21.8239   10.5000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   21.8239   11.9000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   23.0363   12.6000    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   20.6114   12.6000    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   21.8239    7.7000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   21.8239    6.3000    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   20.6114    8.4000    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
   19.3990    7.7000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    4.8498    6.3000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   19.3990    6.3000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   18.1866    5.6000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   18.1866    4.2000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   16.9741    3.5000    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
   16.9741    2.1000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   18.1866    1.4000    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
   15.7617    1.4000    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
   14.5493    2.1000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   15.7617    0.0000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   18.1866    8.4000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   18.1866    9.8000    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   16.9741    7.7000    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
   15.7617    8.4000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.0000    7.7000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   15.7617    9.8000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   14.5493   10.5000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   14.5493   11.9000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   13.3368   12.6000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   12.1244   11.9000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   12.1244   10.5000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   13.3368    9.8000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   14.5493    7.7000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   14.5493    6.3000    0.0000 O   0  3  0  0  0  0  0  0  0  0  0  0
   13.3368    8.4000    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
   12.1244    7.7000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.2124    8.4000    0.0000 S   0  0  0  0  0  0  0  0  0  0  0  0
   12.1244    6.3000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   13.3368    5.6000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   13.3368    4.2000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   12.1244    3.5000    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   14.5493    3.5000    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   10.9119    8.4000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   10.9119    9.8000    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    9.6995    7.7000    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
    8.4871    8.4000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.4249    7.7000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    8.4871    9.8000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    7.2746   10.5000    0.0000 S   0  0  0  0  0  0  0  0  0  0  0  0
    7.2746    7.7000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    7.2746    6.3000    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    6.0622    8.4000    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
    4.8498    7.7000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.6373    8.4000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   13.7207    7.4285    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
  2  1  1  0  0  0  0
  3  2  1  0  0  0  0
  4  3  2  0  0  0  0
  5  3  1  0  0  0  0
  6  5  1  6  0  0  0
  7 29  1  0  0  0  0
  8  6  1  0  0  0  0
  9  8  1  0  0  0  0
 10  9  1  0  0  0  0
 11 10  1  0  0  0  0
 12 11  1  0  0  0  0
 13 12  2  0  0  0  0
 14 12  1  0  0  0  0
 15  6  1  0  0  0  0
 16 15  2  0  0  0  0
 17 15  1  0  0  0  0
 18 17  1  6  0  0  0
 19 29  2  0  0  0  0
 20 18  1  0  0  0  0
 21 20  1  0  0  0  0
 22 21  1  0  0  0  0
 23 22  2  0  0  0  0
 24 22  1  0  0  0  0
 25 18  1  0  0  0  0
 26 25  2  0  0  0  0
 27 25  1  0  0  0  0
 28 27  1  1  0  0  0
 29 71  1  0  0  0  0
 30 28  1  0  0  0  0
 31 30  1  0  0  0  0
 32 31  1  0  0  0  0
 33 32  1  0  0  0  0
 34 33  1  0  0  0  0
 35 34  2  0  0  0  0
 36 34  1  0  0  0  0
 37 36  1  0  0  0  0
 38 36  1  0  0  0  0
 39 28  1  0  0  0  0
 40 39  2  0  0  0  0
 41 39  1  0  0  0  0
 42 41  1  6  0  0  0
 43 55  1  0  0  0  0
 44 42  1  0  0  0  0
 45 44  1  0  0  0  0
 46 45  2  0  0  0  0
 47 46  1  0  0  0  0
 48 47  2  0  0  0  0
 49 48  1  0  0  0  0
 50 49  2  0  0  0  0
 50 45  1  0  0  0  0
 51 42  1  0  0  0  0
 52 51  2  0  0  0  0
 53 51  1  0  0  0  0
 54 53  1  1  0  0  0
 55 65  1  0  0  0  0
 56 54  1  0  0  0  0
 57 56  1  0  0  0  0
 58 57  1  0  0  0  0
 59 58  2  0  0  0  0
 60 58  1  0  0  0  0
 61 54  1  0  0  0  0
 62 61  2  0  0  0  0
 63 61  1  0  0  0  0
 64 63  1  6  0  0  0
 65 72  1  0  0  0  0
 66 64  1  0  0  0  0
 67 66  1  0  0  0  0
 68 64  1  0  0  0  0
 69 68  2  0  0  0  0
 70 68  1  0  0  0  0
 71 70  1  1  0  0  0
 72 71  1  0  0  0  0
 52 73  1  0  0  0  0
M  END
$$$$

Download SDF Structure in 3D SDF:

FYI-1006210-3D
FYIcenter.com

146146  0  0  1  0  0  0  0  0999 V2000
   -6.5359  -29.3808  -12.0545 C   0  0  0  0  0  0  0  0  0  0  0  0
   -5.4477  -29.3508  -11.2479 O   0  3  0  0  0  0  0  0  0  0  0  0
   -4.9738  -30.3039  -10.5139 C   0  0  0  0  0  0  0  0  0  0  0  0
   -5.4379  -31.5853  -10.4063 N   0  0  0  0  0  0  0  0  0  0  0  0
   -6.4661  -32.4136  -11.1162 C   0  0  1  0  0  0  0  0  0  0  0  0
   -6.2771  -33.9133  -10.7723 C   0  0  0  0  0  0  0  0  0  0  0  0
   -4.9366  -34.5344  -11.1769 C   0  0  0  0  0  0  0  0  0  0  0  0
   -4.7137  -34.5313  -12.6678 C   0  0  0  0  0  0  0  0  0  0  0  0
   -5.4582  -33.9934  -13.4735 O   0  0  0  0  0  0  0  0  0  0  0  0
   -3.5762  -35.1580  -13.0270 O   0  0  0  0  0  0  0  0  0  0  0  0
   -7.9406  -32.0022  -10.7678 C   0  0  0  0  0  0  0  0  0  0  0  0
   -8.1834  -30.9423  -10.1911 O   0  0  0  0  0  0  0  0  0  0  0  0
   -8.9459  -32.8022  -11.2627 N   0  0  0  0  0  0  0  0  0  0  0  0
  -10.3857  -32.5624  -11.0371 C   0  0  1  0  0  0  0  0  0  0  0  0
  -10.9547  -31.4790  -11.9690 C   0  0  0  0  0  0  0  0  0  0  0  0
  -10.8980  -31.9115  -13.7420 S   0  0  0  0  0  0  0  0  0  0  0  0
  -11.1535  -33.9040  -11.1821 C   0  0  0  0  0  0  0  0  0  0  0  0
  -10.6078  -34.9313  -11.5911 O   0  0  0  0  0  0  0  0  0  0  0  0
  -12.4791  -33.8996  -10.8188 N   0  0  0  0  0  0  0  0  0  0  0  0
  -13.4069  -35.0218  -11.0932 C   0  0  2  0  0  0  0  0  0  0  0  0
  -14.8795  -34.5903  -10.9201 C   0  0  0  0  0  0  0  0  0  0  0  0
  -15.3272  -33.3835  -11.7426 C   0  0  0  0  0  0  0  0  0  0  0  0
  -15.0953  -33.6264  -13.5267 S   0  0  0  0  0  0  0  0  0  0  0  0
  -15.6143  -31.9859  -14.0844 C   0  0  0  0  0  0  0  0  0  0  0  0
  -13.1421  -36.2495  -10.1891 C   0  0  0  0  0  0  0  0  0  0  0  0
  -13.9734  -36.7609   -9.4504 O   0  0  0  0  0  0  0  0  0  0  0  0
  -11.9006  -36.7713  -10.3216 O   0  0  0  0  0  0  0  0  0  0  0  0
   -3.6748  -29.8755   -9.6880 C   0  0  2  0  0  0  0  0  0  0  0  0
   -3.7420  -30.1268   -8.1620 C   0  0  0  0  0  0  0  0  0  0  0  0
   -4.8975  -29.3767   -7.5476 C   0  0  0  0  0  0  0  0  0  0  0  0
   -6.1682  -29.9613   -7.5160 C   0  0  0  0  0  0  0  0  0  0  0  0
   -7.2949  -29.1708   -7.3123 C   0  0  0  0  0  0  0  0  0  0  0  0
   -7.1560  -27.8006   -7.0996 C   0  0  0  0  0  0  0  0  0  0  0  0
   -5.8859  -27.2405   -6.9826 C   0  0  0  0  0  0  0  0  0  0  0  0
   -4.7594  -28.0331   -7.1867 C   0  0  0  0  0  0  0  0  0  0  0  0
   -3.4450  -28.4518  -10.0143 N   0  0  0  0  0  0  0  0  0  0  0  0
   -2.3374  -27.7077   -9.6857 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.3955  -28.1849   -9.0678 O   0  0  0  0  0  0  0  0  0  0  0  0
   -2.3337  -26.2693  -10.2653 C   0  0  2  0  0  0  0  0  0  0  0  0
   -1.6284  -26.2746  -11.6316 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.3361  -27.1975  -12.6231 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.6614  -27.2797  -13.9926 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.3707  -28.2136  -14.8593 N   0  0  0  0  0  0  0  0  0  0  0  0
   -2.4633  -29.5585  -14.6088 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.9823  -30.1895  -13.5778 N   0  0  0  0  0  0  0  0  0  0  0  0
   -3.1700  -30.2558  -15.5713 N   0  0  0  0  0  0  0  0  0  0  0  0
   -3.8610  -29.7332  -16.7535 C   0  0  0  0  0  0  0  0  0  0  0  0
   -3.1849  -31.7250  -15.5386 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.6567  -25.3429   -9.3618 N   0  0  0  0  0  0  0  0  0  0  0  0
   -2.3306  -24.8132   -8.2792 C   0  0  0  0  0  0  0  0  0  0  0  0
   -3.5485  -24.9281   -8.1405 O   0  0  0  0  0  0  0  0  0  0  0  0
   -1.4489  -24.0279   -7.2916 C   0  0  2  0  0  0  0  0  0  0  0  0
   -1.8078  -22.5470   -7.2404 C   0  0  0  0  0  0  0  0  0  0  0  0
   -3.2241  -22.2358   -6.7501 C   0  0  0  0  0  0  0  0  0  0  0  0
   -3.4243  -20.7475   -6.8151 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.5827  -19.9524   -7.1986 O   0  0  0  0  0  0  0  0  0  0  0  0
   -4.6575  -20.3511   -6.4262 O   0  0  0  0  0  0  0  0  0  0  0  0
   -0.0500  -24.1679   -7.6764 N   0  0  0  0  0  0  0  0  0  0  0  0
    0.7728  -25.0774   -7.0303 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.3489  -25.8941   -6.2153 O   0  0  0  0  0  0  0  0  0  0  0  0
    2.2979  -24.9932   -7.4343 C   0  0  2  0  0  0  0  0  0  0  0  0
    3.1739  -24.9974   -6.1714 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.0023  -26.2416   -5.3009 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.8595  -26.1748   -4.0524 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.5527  -27.3094   -3.2031 N   0  0  0  0  0  0  0  0  0  0  0  0
    4.1885  -27.5582   -2.0458 C   0  0  0  0  0  0  0  0  0  0  0  0
    5.3757  -27.2259   -1.7048 N   0  0  0  0  0  0  0  0  0  0  0  0
    3.4157  -28.2559   -1.1917 N   0  0  0  0  0  0  0  0  0  0  0  0
    2.6757  -23.8167   -8.2509 N   0  0  0  0  0  0  0  0  0  0  0  0
    2.5052  -23.7785   -9.6292 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.0092  -24.7009  -10.2767 O   0  0  0  0  0  0  0  0  0  0  0  0
    2.9021  -22.4557  -10.3043 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.2520  -21.4162   -9.3137 N   0  0  0  0  0  0  0  0  0  0  0  0
   -6.2859  -28.8024  -12.9511 H   0  0  0  0  0  0  0  0  0  0  0  0
   -7.3422  -28.8168  -11.5733 H   0  0  0  0  0  0  0  0  0  0  0  0
   -6.8914  -30.3464  -12.3719 H   0  0  0  0  0  0  0  0  0  0  0  0
   -4.9055  -32.1249   -9.7355 H   0  0  0  0  0  0  0  0  0  0  0  0
   -6.3334  -32.2446  -12.1859 H   0  0  0  0  0  0  0  0  0  0  0  0
   -7.0624  -34.5137  -11.2450 H   0  0  0  0  0  0  0  0  0  0  0  0
   -6.4094  -34.0445   -9.6904 H   0  0  0  0  0  0  0  0  0  0  0  0
   -4.9388  -35.5801  -10.8469 H   0  0  0  0  0  0  0  0  0  0  0  0
   -4.1057  -34.0153  -10.6924 H   0  0  0  0  0  0  0  0  0  0  0  0
   -3.0793  -35.5833  -12.2985 H   0  0  0  0  0  0  0  0  0  0  0  0
   -8.7463  -33.6132  -11.8441 H   0  0  0  0  0  0  0  0  0  0  0  0
  -10.4974  -32.2283   -9.9986 H   0  0  0  0  0  0  0  0  0  0  0  0
  -10.3801  -30.5536  -11.8579 H   0  0  0  0  0  0  0  0  0  0  0  0
  -11.9943  -31.2501  -11.7132 H   0  0  0  0  0  0  0  0  0  0  0  0
  -11.7887  -32.9207  -13.7074 H   0  0  0  0  0  0  0  0  0  0  0  0
  -12.8933  -33.0372  -10.4905 H   0  0  0  0  0  0  0  0  0  0  0  0
  -13.2361  -35.3613  -12.1221 H   0  0  0  0  0  0  0  0  0  0  0  0
  -15.5379  -35.4405  -11.1481 H   0  0  0  0  0  0  0  0  0  0  0  0
  -15.0595  -34.3519   -9.8625 H   0  0  0  0  0  0  0  0  0  0  0  0
  -14.7681  -32.4933  -11.4390 H   0  0  0  0  0  0  0  0  0  0  0  0
  -16.3870  -33.1876  -11.5461 H   0  0  0  0  0  0  0  0  0  0  0  0
  -15.5644  -31.9411  -15.1748 H   0  0  0  0  0  0  0  0  0  0  0  0
  -14.9432  -31.2278  -13.6724 H   0  0  0  0  0  0  0  0  0  0  0  0
  -16.6404  -31.7796  -13.7693 H   0  0  0  0  0  0  0  0  0  0  0  0
  -11.3444  -36.2832  -10.9747 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.8319  -30.4454  -10.0981 H   0  0  0  0  0  0  0  0  0  0  0  0
   -3.8421  -31.1979   -7.9529 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.8052  -29.8193   -7.6766 H   0  0  0  0  0  0  0  0  0  0  0  0
   -6.2902  -31.0258   -7.6790 H   0  0  0  0  0  0  0  0  0  0  0  0
   -8.2834  -29.6184   -7.3518 H   0  0  0  0  0  0  0  0  0  0  0  0
   -8.0368  -27.1721   -7.0043 H   0  0  0  0  0  0  0  0  0  0  0  0
   -5.7854  -26.1819   -6.7586 H   0  0  0  0  0  0  0  0  0  0  0  0
   -3.7673  -27.5864   -7.1121 H   0  0  0  0  0  0  0  0  0  0  0  0
   -4.1919  -28.0069  -10.5354 H   0  0  0  0  0  0  0  0  0  0  0  0
   -3.3709  -25.9341  -10.3748 H   0  0  0  0  0  0  0  0  0  0  0  0
   -1.5958  -25.2539  -12.0296 H   0  0  0  0  0  0  0  0  0  0  0  0
   -0.5859  -26.5985  -11.5054 H   0  0  0  0  0  0  0  0  0  0  0  0
   -3.3847  -26.8979  -12.7310 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.3544  -28.1948  -12.1881 H   0  0  0  0  0  0  0  0  0  0  0  0
   -0.6147  -27.5884  -13.8952 H   0  0  0  0  0  0  0  0  0  0  0  0
   -1.6727  -26.2870  -14.4539 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.2803  -27.9866  -15.8419 H   0  0  0  0  0  0  0  0  0  0  0  0
   -1.3682  -29.6432  -12.9796 H   0  0  0  0  0  0  0  0  0  0  0  0
   -3.8855  -28.6428  -16.8120 H   0  0  0  0  0  0  0  0  0  0  0  0
   -4.9017  -30.0756  -16.7605 H   0  0  0  0  0  0  0  0  0  0  0  0
   -3.3766  -30.1045  -17.6646 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.6664  -32.1598  -14.6796 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.7073  -32.1241  -16.4410 H   0  0  0  0  0  0  0  0  0  0  0  0
   -4.2189  -32.0860  -15.5119 H   0  0  0  0  0  0  0  0  0  0  0  0
   -0.6428  -25.3712   -9.3433 H   0  0  0  0  0  0  0  0  0  0  0  0
   -1.5909  -24.4699   -6.2977 H   0  0  0  0  0  0  0  0  0  0  0  0
   -1.0957  -22.0370   -6.5728 H   0  0  0  0  0  0  0  0  0  0  0  0
   -1.6568  -22.1022   -8.2325 H   0  0  0  0  0  0  0  0  0  0  0  0
   -3.3594  -22.5781   -5.7201 H   0  0  0  0  0  0  0  0  0  0  0  0
   -3.9790  -22.6954   -7.3915 H   0  0  0  0  0  0  0  0  0  0  0  0
   -5.2801  -21.0455   -6.1390 H   0  0  0  0  0  0  0  0  0  0  0  0
    0.4064  -23.3947   -8.1599 H   0  0  0  0  0  0  0  0  0  0  0  0
    2.5045  -25.8861   -8.0376 H   0  0  0  0  0  0  0  0  0  0  0  0
    4.2289  -24.9189   -6.4672 H   0  0  0  0  0  0  0  0  0  0  0  0
    2.9526  -24.1010   -5.5770 H   0  0  0  0  0  0  0  0  0  0  0  0
    3.2223  -27.1449   -5.8817 H   0  0  0  0  0  0  0  0  0  0  0  0
    1.9773  -26.3360   -4.9443 H   0  0  0  0  0  0  0  0  0  0  0  0
    3.6458  -25.2529   -3.4998 H   0  0  0  0  0  0  0  0  0  0  0  0
    4.9160  -26.1736   -4.3349 H   0  0  0  0  0  0  0  0  0  0  0  0
    2.5536  -27.4406   -3.0809 H   0  0  0  0  0  0  0  0  0  0  0  0
    5.8210  -26.7386   -2.4819 H   0  0  0  0  0  0  0  0  0  0  0  0
    2.9739  -29.0467   -1.6374 H   0  0  0  0  0  0  0  0  0  0  0  0
    3.9881  -28.5457   -0.4081 H   0  0  0  0  0  0  0  0  0  0  0  0
    3.2062  -23.0528   -7.8381 H   0  0  0  0  0  0  0  0  0  0  0  0
    2.0420  -22.1144  -10.8923 H   0  0  0  0  0  0  0  0  0  0  0  0
    3.7446  -22.6410  -10.9771 H   0  0  0  0  0  0  0  0  0  0  0  0
    2.4215  -21.2086   -8.7537 H   0  0  0  0  0  0  0  0  0  0  0  0
    3.4412  -20.5514   -9.8271 H   0  0  0  0  0  0  0  0  0  0  0  0
  1  2  1  0  0  0  0
  1 74  1  0  0  0  0
  1 75  1  0  0  0  0
  1 76  1  0  0  0  0
  2  3  2  0  0  0  0
  3  4  1  0  0  0  0
  4  5  1  0  0  0  0
  4 77  1  0  0  0  0
  5  6  1  0  0  0  0
  5 11  1  0  0  0  0
  5 78  1  6  0  0  0
  6  7  1  0  0  0  0
  6 79  1  0  0  0  0
  6 80  1  0  0  0  0
  7  8  1  0  0  0  0
  7 81  1  0  0  0  0
  7 82  1  0  0  0  0
  8  9  2  0  0  0  0
  8 10  1  0  0  0  0
 10 83  1  0  0  0  0
 11 12  2  0  0  0  0
 11 13  1  0  0  0  0
 13 14  1  0  0  0  0
 13 84  1  0  0  0  0
 14 15  1  0  0  0  0
 14 17  1  0  0  0  0
 14 85  1  1  0  0  0
 15 16  1  0  0  0  0
 15 86  1  0  0  0  0
 15 87  1  0  0  0  0
 16 88  1  0  0  0  0
 17 18  2  0  0  0  0
 17 19  1  0  0  0  0
 19 89  1  0  0  0  0
 20 25  1  0  0  0  0
 20 21  1  0  0  0  0
 20 19  1  0  0  0  0
 20 90  1  6  0  0  0
 21 22  1  0  0  0  0
 21 91  1  0  0  0  0
 21 92  1  0  0  0  0
 22 23  1  0  0  0  0
 22 93  1  0  0  0  0
 22 94  1  0  0  0  0
 23 24  1  0  0  0  0
 24 95  1  0  0  0  0
 24 96  1  0  0  0  0
 24 97  1  0  0  0  0
 25 26  2  0  0  0  0
 25 27  1  0  0  0  0
 27 98  1  0  0  0  0
 28 36  1  0  0  0  0
 28 29  1  0  0  0  0
 28  3  1  0  0  0  0
 28 99  1  6  0  0  0
 29 30  1  0  0  0  0
 29100  1  0  0  0  0
 29101  1  0  0  0  0
 30 31  1  0  0  0  0
 30 35  2  0  0  0  0
 31 32  2  0  0  0  0
 31102  1  0  0  0  0
 32 33  1  0  0  0  0
 32103  1  0  0  0  0
 33 34  2  0  0  0  0
 33104  1  0  0  0  0
 34 35  1  0  0  0  0
 34105  1  0  0  0  0
 35106  1  0  0  0  0
 36 37  1  0  0  0  0
 36107  1  0  0  0  0
 37 38  2  0  0  0  0
 39 49  1  0  0  0  0
 39 40  1  0  0  0  0
 39 37  1  0  0  0  0
 39108  1  6  0  0  0
 40 41  1  0  0  0  0
 40109  1  0  0  0  0
 40110  1  0  0  0  0
 41 42  1  0  0  0  0
 41111  1  0  0  0  0
 41112  1  0  0  0  0
 42 43  1  0  0  0  0
 42113  1  0  0  0  0
 42114  1  0  0  0  0
 43 44  1  0  0  0  0
 43115  1  0  0  0  0
 44 45  2  0  0  0  0
 44 46  1  0  0  0  0
 45116  1  0  0  0  0
 46 47  1  0  0  0  0
 46 48  1  0  0  0  0
 47117  1  0  0  0  0
 47118  1  0  0  0  0
 47119  1  0  0  0  0
 48120  1  0  0  0  0
 48121  1  0  0  0  0
 48122  1  0  0  0  0
 49 50  1  0  0  0  0
 49123  1  0  0  0  0
 50 51  2  0  0  0  0
 52 58  1  0  0  0  0
 52 53  1  0  0  0  0
 52 50  1  0  0  0  0
 52124  1  1  0  0  0
 53 54  1  0  0  0  0
 53125  1  0  0  0  0
 53126  1  0  0  0  0
 54 55  1  0  0  0  0
 54127  1  0  0  0  0
 54128  1  0  0  0  0
 55 56  2  0  0  0  0
 55 57  1  0  0  0  0
 57129  1  0  0  0  0
 58 59  1  0  0  0  0
 58130  1  0  0  0  0
 59 60  2  0  0  0  0
 61 69  1  0  0  0  0
 61 62  1  0  0  0  0
 61 59  1  0  0  0  0
 61131  1  6  0  0  0
 62 63  1  0  0  0  0
 62132  1  0  0  0  0
 62133  1  0  0  0  0
 63 64  1  0  0  0  0
 63134  1  0  0  0  0
 63135  1  0  0  0  0
 64 65  1  0  0  0  0
 64136  1  0  0  0  0
 64137  1  0  0  0  0
 65 66  1  0  0  0  0
 65138  1  0  0  0  0
 66 67  2  0  0  0  0
 66 68  1  0  0  0  0
 67139  1  0  0  0  0
 68140  1  0  0  0  0
 68141  1  0  0  0  0
 69 70  1  0  0  0  0
 69142  1  0  0  0  0
 70 71  2  0  0  0  0
 70 72  1  0  0  0  0
 72 73  1  0  0  0  0
 72143  1  0  0  0  0
 72144  1  0  0  0  0
 73145  1  0  0  0  0
 73146  1  0  0  0  0
M  END
$$$$

✍: FYIcenter.com

2023-12-10, 2353👍, 0💬