| 6d07_ligand | |
| RDKit 3D | |
| 153152 0 0 0 0 0 0 0 0999 V2000 | |
| 10.3736 -3.5329 0.6498 N 0 0 0 0 0 4 0 0 0 0 0 0 | |
| 10.6390 -2.6693 1.8625 C 0 0 2 0 0 0 0 0 0 0 0 0 | |
| 10.0065 -1.2660 1.6376 C 0 0 0 0 0 0 0 0 0 0 0 0 | |
| 10.6657 -0.2437 1.4855 O 0 0 0 0 0 0 0 0 0 0 0 0 | |
| 12.1448 -2.7339 2.1946 C 0 0 0 0 0 0 0 0 0 0 0 0 | |
| 13.0828 -1.5950 1.7606 C 0 0 0 0 0 0 0 0 0 0 0 0 | |
| 13.2000 -1.3576 0.2510 C 0 0 0 0 0 0 0 0 0 0 0 0 | |
| 13.8209 0.0029 -0.0813 C 0 0 0 0 0 0 0 0 0 0 0 0 | |
| 12.8227 1.0800 0.0872 N 0 0 0 0 0 4 0 0 0 0 0 0 | |
| 8.6439 -1.3178 1.4377 N 0 0 0 0 0 0 0 0 0 0 0 0 | |
| 7.8042 -0.1540 1.0824 C 0 0 2 0 0 0 0 0 0 0 0 0 | |
| 6.3888 -0.7002 0.7880 C 0 0 0 0 0 0 0 0 0 0 0 0 | |
| 6.2136 -1.8985 0.5702 O 0 0 0 0 0 0 0 0 0 0 0 0 | |
| 8.3263 0.6508 -0.1191 C 0 0 0 0 0 0 0 0 0 0 0 0 | |
| 8.5983 -0.1979 -1.3658 C 0 0 0 0 0 0 0 0 0 0 0 0 | |
| 9.8217 0.2860 -2.1221 C 0 0 0 0 0 0 0 0 0 0 0 0 | |
| 10.8637 0.6262 -1.5635 O 0 0 0 0 0 0 0 0 0 0 0 0 | |
| 9.7300 0.2228 -3.4769 N 0 0 0 0 0 0 0 0 0 0 0 0 | |
| 5.4085 0.2537 0.7460 N 0 0 0 0 0 0 0 0 0 0 0 0 | |
| 3.9729 -0.0358 0.5797 C 0 0 2 0 0 0 0 0 0 0 0 0 | |
| 3.4089 1.2401 -0.0776 C 0 0 0 0 0 0 0 0 0 0 0 0 | |
| 3.9965 2.3190 0.0476 O 0 0 0 0 0 0 0 0 0 0 0 0 | |
| 3.2756 -0.2924 1.9368 C 0 0 2 0 0 0 0 0 0 0 0 0 | |
| 4.1123 -1.0824 2.7950 O 0 0 0 0 0 0 0 0 0 0 0 0 | |
| 1.9426 -1.0115 1.7755 C 0 0 0 0 0 0 0 0 0 0 0 0 | |
| 2.2247 1.1256 -0.7781 N 0 0 0 0 0 0 0 0 0 0 0 0 | |
| 1.7499 2.2683 -1.5782 C 0 0 2 0 0 0 0 0 0 0 0 0 | |
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| 2.4457 2.2883 -2.9375 C 0 0 0 0 0 0 0 0 0 0 0 0 | |
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| -1.9787 1.5911 -0.8555 C 0 0 2 0 0 0 0 0 0 0 0 0 | |
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| -7.3666 1.9297 0.0216 C 0 0 0 0 0 0 0 0 0 0 0 0 | |
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| -8.8063 -2.3219 -1.9697 C 0 0 2 0 0 0 0 0 0 0 0 0 | |
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| 12.2258 -2.7832 3.2865 H 0 0 0 0 0 0 0 0 0 0 0 0 | |
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| 14.0918 -1.8333 2.1369 H 0 0 0 0 0 0 0 0 0 0 0 0 | |
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| 12.2316 -1.4436 -0.2484 H 0 0 0 0 0 0 0 0 0 0 0 0 | |
| 14.6738 0.2348 0.5669 H 0 0 0 0 0 0 0 0 0 0 0 0 | |
| 14.1378 0.0464 -1.1251 H 0 0 0 0 0 0 0 0 0 0 0 0 | |
| 12.0220 0.9517 -0.5665 H 0 0 0 0 0 0 0 0 0 0 0 0 | |
| 13.2139 2.0089 -0.1232 H 0 0 0 0 0 0 0 0 0 0 0 0 | |
| 12.3961 1.1212 1.0309 H 0 0 0 0 0 0 0 0 0 0 0 0 | |
| 8.0904 -2.0939 1.8099 H 0 0 0 0 0 0 0 0 0 0 0 0 | |
| 7.7564 0.4818 1.9747 H 0 0 0 0 0 0 0 0 0 0 0 0 | |
| 7.5993 1.4250 -0.3891 H 0 0 0 0 0 0 0 0 0 0 0 0 | |
| 9.2188 1.2087 0.1834 H 0 0 0 0 0 0 0 0 0 0 0 0 | |
| 8.8032 -1.2466 -1.1197 H 0 0 0 0 0 0 0 0 0 0 0 0 | |
| 7.7069 -0.1965 -2.0109 H 0 0 0 0 0 0 0 0 0 0 0 0 | |
| 10.4602 0.6419 -4.0452 H 0 0 0 0 0 0 0 0 0 0 0 0 | |
| 8.8614 0.0292 -3.9628 H 0 0 0 0 0 0 0 0 0 0 0 0 | |
| 5.6156 1.2210 0.9849 H 0 0 0 0 0 0 0 0 0 0 0 0 | |
| 3.8768 -0.8943 -0.0951 H 0 0 0 0 0 0 0 0 0 0 0 0 | |
| 3.1119 0.6573 2.4558 H 0 0 0 0 0 0 0 0 0 0 0 0 | |
| 3.5899 -1.3186 3.5822 H 0 0 0 0 0 0 0 0 0 0 0 0 | |
| 1.2299 -0.4211 1.1975 H 0 0 0 0 0 0 0 0 0 0 0 0 | |
| 2.0792 -1.9796 1.2845 H 0 0 0 0 0 0 0 0 0 0 0 0 | |
| 1.4924 -1.2171 2.7544 H 0 0 0 0 0 0 0 0 0 0 0 0 | |
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| M CHG 5 1 1 9 1 40 1 48 1 70 -1 | |
| M END | |
| > <_TriposChargeType> (1) | |
| GAST_HUCK | |
| $$$$ | |