Spaces:
Runtime error
Runtime error
| 6ahs_ligand | |
| -I-interpret- | |
| 44 47 0 0 0 0 0 0 0 0999 V2000 | |
| -12.3770 21.8080 53.5010 C 0 0 0 0 0 | |
| -13.7990 19.8830 53.8470 C 0 0 0 0 0 | |
| -12.7140 27.6870 53.9730 C 0 0 0 0 0 | |
| -14.5790 28.9380 54.4000 C 0 0 0 0 0 | |
| -15.0000 26.1900 58.7440 C 0 0 0 0 0 | |
| -10.5140 22.1070 55.1220 O 0 0 0 0 0 | |
| -11.1780 22.7720 54.0310 S 0 0 0 0 0 | |
| -10.2040 22.9400 53.0000 O 0 0 0 0 0 | |
| -12.7440 20.6930 54.2570 C 0 0 0 0 0 | |
| -13.0670 22.0720 52.3070 C 0 0 0 0 0 | |
| -12.6220 23.4480 51.2580 Cl 0 0 0 0 0 | |
| -14.1300 21.2760 51.9160 C 0 0 0 0 0 | |
| -14.4890 20.1760 52.6790 C 0 0 0 0 0 | |
| -11.7830 24.2640 54.5210 N 0 0 0 0 0 | |
| -11.7700 25.3520 53.7050 C 0 0 0 0 0 | |
| -12.5570 24.4620 55.6400 C 0 0 0 0 0 | |
| -12.9850 23.6850 56.7070 C 0 0 0 0 0 | |
| -13.0050 25.7840 55.5680 C 0 0 0 0 0 | |
| -13.7490 26.3750 56.5810 C 0 0 0 0 0 | |
| -14.1450 25.5950 57.6610 C 0 0 0 0 0 | |
| -13.7760 24.2500 57.7130 C 0 0 0 0 0 | |
| -12.3430 26.3420 54.5030 C 0 0 0 0 0 | |
| -14.1740 27.8640 53.8610 N 0 0 0 0 0 | |
| -12.3600 28.8800 54.9120 C 0 0 0 0 0 | |
| -13.6180 29.6030 54.9940 N 0 0 0 0 0 | |
| -16.0210 29.3400 54.4520 C 0 0 0 0 0 | |
| -14.0838 19.0169 54.4444 H 0 0 0 0 0 | |
| -12.1648 27.7040 53.0316 H 0 0 0 0 0 | |
| -14.4736 27.0274 59.2019 H 0 0 0 0 0 | |
| -15.9379 26.5405 58.3133 H 0 0 0 0 0 | |
| -15.2065 25.4321 59.4997 H 0 0 0 0 0 | |
| -12.2019 20.4558 55.1724 H 0 0 0 0 0 | |
| -14.6845 21.5143 51.0083 H 0 0 0 0 0 | |
| -15.3149 19.5397 52.3611 H 0 0 0 0 0 | |
| -11.4030 25.4307 52.6817 H 0 0 0 0 0 | |
| -12.7045 22.6331 56.7614 H 0 0 0 0 0 | |
| -14.0172 27.4303 56.5300 H 0 0 0 0 0 | |
| -14.1081 23.6324 58.5475 H 0 0 0 0 0 | |
| -11.5409 29.4916 54.5336 H 0 0 0 0 0 | |
| -11.9880 28.5603 55.8854 H 0 0 0 0 0 | |
| -13.7372 30.5065 55.4522 H 0 0 0 0 0 | |
| -16.4083 29.4311 53.4372 H 0 0 0 0 0 | |
| -16.5888 28.5825 54.9924 H 0 0 0 0 0 | |
| -16.1116 30.2979 54.9641 H 0 0 0 0 0 | |
| 7 1 1 0 0 0 | |
| 1 9 4 0 0 0 | |
| 1 10 4 0 0 0 | |
| 9 2 4 0 0 0 | |
| 2 13 4 0 0 0 | |
| 22 3 1 0 0 0 | |
| 3 23 1 0 0 0 | |
| 3 24 1 0 0 0 | |
| 23 4 2 0 0 0 | |
| 4 25 1 0 0 0 | |
| 4 26 1 0 0 0 | |
| 20 5 1 0 0 0 | |
| 7 6 2 0 0 0 | |
| 7 8 2 0 0 0 | |
| 14 7 1 0 0 0 | |
| 10 11 1 0 0 0 | |
| 10 12 4 0 0 0 | |
| 12 13 4 0 0 0 | |
| 15 14 4 0 0 0 | |
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| 18 16 4 0 0 0 | |
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| 18 22 4 0 0 0 | |
| 19 20 4 0 0 0 | |
| 20 21 4 0 0 0 | |
| 24 25 1 0 0 0 | |
| 2 27 1 0 0 0 | |
| 3 28 1 0 0 0 | |
| 5 29 1 0 0 0 | |
| 5 30 1 0 0 0 | |
| 5 31 1 0 0 0 | |
| 9 32 1 0 0 0 | |
| 12 33 1 0 0 0 | |
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| 24 40 1 0 0 0 | |
| 25 41 1 0 0 0 | |
| 26 42 1 0 0 0 | |
| 26 43 1 0 0 0 | |
| 26 44 1 0 0 0 | |
| M END | |
| $$$$ | |