5ze6_ligand RDKit 3D 58 58 0 0 0 0 0 0 0 0999 V2000 -6.0926 3.1591 2.2235 C 0 0 0 0 0 0 0 0 0 0 0 0 4.8238 -1.8911 1.6652 O 0 0 0 0 0 1 0 0 0 0 0 0 6.8432 -1.2807 2.4572 O 0 0 0 0 0 0 0 0 0 0 0 0 8.4184 0.1596 1.2384 O 0 0 0 0 0 0 0 0 0 0 0 0 6.9236 1.1962 -1.8975 C 0 0 0 0 0 0 0 0 0 0 0 0 7.8170 1.0337 -0.8490 C 0 0 0 0 0 0 0 0 0 0 0 0 5.6935 0.5476 -1.8454 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.7100 3.1835 0.7528 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.2160 3.4123 0.5182 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.2780 2.3540 1.1102 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.5556 0.9374 0.6016 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.4870 -0.0419 1.0945 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.7932 -1.5033 0.7551 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.9526 -1.8250 -0.7314 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.7734 -1.4729 -1.6460 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.5166 -2.3304 -1.4429 C 0 0 0 0 0 0 0 0 0 0 0 0 0.4825 -1.7201 -0.4569 C 0 0 0 0 0 0 0 0 0 0 0 0 1.7654 -2.5453 -0.3161 C 0 0 0 0 0 0 0 0 0 0 0 0 2.6414 -2.5381 -1.5784 C 0 0 0 0 0 0 0 0 0 0 0 0 4.0902 -2.1357 -1.2897 C 0 0 0 0 0 0 0 0 0 0 0 0 4.0859 -0.7866 -0.8083 O 0 0 0 0 0 0 0 0 0 0 0 0 5.9210 -1.2627 1.5679 C 0 0 0 0 0 0 0 0 0 0 0 0 7.4708 0.2336 0.2429 C 0 0 0 0 0 0 0 0 0 0 0 0 5.3549 -0.2738 -0.7545 C 0 0 0 0 0 0 0 0 0 0 0 0 6.2307 -0.4402 0.3317 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.6502 2.3033 2.7416 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.7664 4.0749 2.7263 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.1802 3.0852 2.3281 H 0 0 0 0 0 0 0 0 0 0 0 0 8.0245 -0.4451 1.9276 H 0 0 0 0 0 0 0 0 0 0 0 0 7.1775 1.8273 -2.7417 H 0 0 0 0 0 0 0 0 0 0 0 0 8.7788 1.5383 -0.8605 H 0 0 0 0 0 0 0 0 0 0 0 0 4.9762 0.6846 -2.6497 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.0362 2.2539 0.2729 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.2617 3.9953 0.2636 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.0386 3.4803 -0.5604 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.9395 4.3869 0.9359 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.2482 2.6348 0.8509 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.3342 2.3739 2.2056 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.5394 0.6024 0.9497 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.5773 0.9477 -0.4932 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.4000 0.0417 2.1856 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.5125 0.2468 0.6863 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.7222 -1.7905 1.2647 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.0142 -2.1420 1.1866 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.1710 -2.8951 -0.8322 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.8428 -1.3076 -1.1099 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.1170 -1.6456 -2.6730 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.5343 -0.4062 -1.5870 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0274 -2.4306 -2.4189 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.7920 -3.3438 -1.1290 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0273 -1.6448 0.5334 H 0 0 0 0 0 0 0 0 0 0 0 0 0.7362 -0.6980 -0.7628 H 0 0 0 0 0 0 0 0 0 0 0 0 2.3234 -2.1604 0.5458 H 0 0 0 0 0 0 0 0 0 0 0 0 1.5031 -3.5822 -0.0704 H 0 0 0 0 0 0 0 0 0 0 0 0 2.2345 -1.8486 -2.3259 H 0 0 0 0 0 0 0 0 0 0 0 0 2.6336 -3.5394 -2.0231 H 0 0 0 0 0 0 0 0 0 0 0 0 4.5332 -2.8214 -0.5618 H 0 0 0 0 0 0 0 0 0 0 0 0 4.6659 -2.2051 -2.2217 H 0 0 0 0 0 0 0 0 0 0 0 0 8 1 1 0 22 2 1 0 22 3 2 0 23 4 1 0 6 5 2 0 5 7 1 0 23 6 1 0 7 24 2 0 9 8 1 0 10 9 1 0 11 10 1 0 12 11 1 0 13 12 1 0 14 13 1 0 15 14 1 0 16 15 1 0 17 16 1 0 18 17 1 0 19 18 1 0 20 19 1 0 21 20 1 0 24 21 1 0 25 22 1 0 23 25 2 0 24 25 1 0 1 26 1 0 1 27 1 0 1 28 1 0 4 29 1 0 5 30 1 0 6 31 1 0 7 32 1 0 8 33 1 0 8 34 1 0 9 35 1 0 9 36 1 0 10 37 1 0 10 38 1 0 11 39 1 0 11 40 1 0 12 41 1 0 12 42 1 0 13 43 1 0 13 44 1 0 14 45 1 0 14 46 1 0 15 47 1 0 15 48 1 0 16 49 1 0 16 50 1 0 17 51 1 0 17 52 1 0 18 53 1 0 18 54 1 0 19 55 1 0 19 56 1 0 20 57 1 0 20 58 1 0 M CHG 1 2 -1 M END > <_TriposChargeType> (1) GAST_HUCK $$$$