| 6dz3_ligand |
| -I-interpret- |
|
|
| 63 66 0 0 0 0 0 0 0 0999 V2000 |
| 85.2160 162.0770 179.0500 O 0 0 0 0 0 |
| 84.7140 161.3060 177.9550 C 0 0 0 0 0 |
| 84.7460 162.2260 176.7440 C 0 0 0 0 0 |
| 85.8600 161.7110 175.9440 N 0 3 0 0 0 |
| 85.8590 162.1990 174.5530 C 0 0 0 0 0 |
| 84.7800 161.7360 173.6100 C 0 0 0 0 0 |
| 83.5030 162.2490 173.4080 C 0 0 0 0 0 |
| 82.8850 163.2840 174.0320 N 0 0 0 0 0 |
| 81.6280 163.6290 173.6720 C 0 0 0 0 0 |
| 80.9690 162.9510 172.7000 N 0 0 0 0 0 |
| 81.5730 161.9240 172.0320 C 0 0 0 0 0 |
| 80.8990 161.2740 171.0510 N 0 0 0 0 0 |
| 82.8790 161.5490 172.3900 C 0 0 0 0 0 |
| 83.7490 160.5980 171.9780 N 0 0 0 0 0 |
| 84.9040 160.6910 172.7030 C 0 0 0 0 0 |
| 85.9410 160.2520 176.1280 C 0 0 0 0 0 |
| 85.5620 160.0670 177.5960 C 0 0 0 0 0 |
| 84.7970 158.7670 177.8160 C 0 0 0 0 0 |
| 85.7500 157.3280 177.4070 S 0 0 0 0 0 |
| 87.2040 157.2530 178.4060 C 0 0 0 0 0 |
| 88.3930 157.7800 177.5980 C 0 0 0 0 0 |
| 89.7750 157.6060 178.2370 C 0 0 0 0 0 |
| 90.7680 158.5320 177.5520 C 0 0 0 0 0 |
| 90.4670 159.7840 177.1310 N 0 0 0 0 0 |
| 91.5830 160.3800 176.5370 N 0 0 0 0 0 |
| 92.5690 159.4090 176.6390 N 0 0 0 0 0 |
| 92.1130 158.2950 177.2370 C 0 0 0 0 0 |
| 93.8330 159.8410 176.0510 C 0 0 0 0 0 |
| 93.5930 160.1950 174.5760 C 0 0 0 0 0 |
| 94.3250 159.8340 172.2080 C 0 0 0 0 0 |
| 94.7100 159.7030 173.6670 C 0 0 0 0 0 |
| 84.6342 162.8243 179.2070 H 0 0 0 0 0 |
| 83.7266 160.9403 178.2369 H 0 0 0 0 0 |
| 84.8818 163.2716 177.0204 H 0 0 0 0 0 |
| 83.8043 162.2228 176.1951 H 0 0 0 0 0 |
| 86.7413 162.0955 176.2843 H 0 0 0 0 0 |
| 86.7857 161.8181 174.1239 H 0 0 0 0 0 |
| 85.7125 163.2759 174.6361 H 0 0 0 0 0 |
| 81.1371 164.4647 174.1707 H 0 0 0 0 0 |
| 79.9465 161.5528 170.8156 H 0 0 0 0 0 |
| 81.3446 160.5063 170.5485 H 0 0 0 0 0 |
| 85.7785 160.0506 172.5884 H 0 0 0 0 0 |
| 86.9273 159.8516 175.8935 H 0 0 0 0 0 |
| 85.2851 159.7046 175.4510 H 0 0 0 0 0 |
| 86.4412 159.9894 178.2356 H 0 0 0 0 0 |
| 83.9213 158.7820 177.1671 H 0 0 0 0 0 |
| 84.5400 158.7067 178.8736 H 0 0 0 0 0 |
| 87.3914 156.2216 178.7048 H 0 0 0 0 0 |
| 87.0678 157.8629 179.2991 H 0 0 0 0 0 |
| 88.2385 158.8540 177.4941 H 0 0 0 0 0 |
| 88.4109 157.2049 176.6722 H 0 0 0 0 0 |
| 90.1018 156.5725 178.1220 H 0 0 0 0 0 |
| 89.7194 157.8520 179.2974 H 0 0 0 0 0 |
| 92.6786 157.3851 177.4377 H 0 0 0 0 0 |
| 94.5691 159.0405 176.1251 H 0 0 0 0 0 |
| 94.2113 160.7129 176.5847 H 0 0 0 0 0 |
| 93.5481 161.2810 174.4947 H 0 0 0 0 0 |
| 92.6675 159.7126 174.2615 H 0 0 0 0 0 |
| 93.4312 159.2408 172.0147 H 0 0 0 0 0 |
| 94.1245 160.8806 171.9790 H 0 0 0 0 0 |
| 95.1432 159.4745 171.5840 H 0 0 0 0 0 |
| 94.8985 158.6517 173.8845 H 0 0 0 0 0 |
| 95.5986 160.3077 173.8484 H 0 0 0 0 0 |
| 1 2 1 0 0 0 |
| 2 3 1 0 0 0 |
| 2 17 1 0 0 0 |
| 3 4 1 0 0 0 |
| 4 5 1 0 0 0 |
| 4 16 1 0 0 0 |
| 5 6 1 0 0 0 |
| 6 7 4 0 0 0 |
| 6 15 4 0 0 0 |
| 7 8 4 0 0 0 |
| 7 13 4 0 0 0 |
| 8 9 4 0 0 0 |
| 9 10 4 0 0 0 |
| 10 11 4 0 0 0 |
| 11 12 1 0 0 0 |
| 11 13 4 0 0 0 |
| 13 14 4 0 0 0 |
| 14 15 4 0 0 0 |
| 16 17 1 0 0 0 |
| 17 18 1 0 0 0 |
| 18 19 1 0 0 0 |
| 19 20 1 0 0 0 |
| 20 21 1 0 0 0 |
| 21 22 1 0 0 0 |
| 22 23 1 0 0 0 |
| 23 24 4 0 0 0 |
| 23 27 4 0 0 0 |
| 24 25 4 0 0 0 |
| 25 26 4 0 0 0 |
| 26 27 4 0 0 0 |
| 26 28 1 0 0 0 |
| 28 29 1 0 0 0 |
| 29 31 1 0 0 0 |
| 31 30 1 0 0 0 |
| 1 32 1 0 0 0 |
| 2 33 1 0 0 0 |
| 3 34 1 0 0 0 |
| 3 35 1 0 0 0 |
| 4 36 1 0 0 0 |
| 5 37 1 0 0 0 |
| 5 38 1 0 0 0 |
| 9 39 1 0 0 0 |
| 12 40 1 0 0 0 |
| 12 41 1 0 0 0 |
| 15 42 1 0 0 0 |
| 16 43 1 0 0 0 |
| 16 44 1 0 0 0 |
| 17 45 1 0 0 0 |
| 18 46 1 0 0 0 |
| 18 47 1 0 0 0 |
| 20 48 1 0 0 0 |
| 20 49 1 0 0 0 |
| 21 50 1 0 0 0 |
| 21 51 1 0 0 0 |
| 22 52 1 0 0 0 |
| 22 53 1 0 0 0 |
| 27 54 1 0 0 0 |
| 28 55 1 0 0 0 |
| 28 56 1 0 0 0 |
| 29 57 1 0 0 0 |
| 29 58 1 0 0 0 |
| 30 59 1 0 0 0 |
| 30 60 1 0 0 0 |
| 30 61 1 0 0 0 |
| 31 62 1 0 0 0 |
| 31 63 1 0 0 0 |
| M END |
| $$$$ |
|
|
