RDKit 3D 58 61 0 0 0 0 0 0 0 0999 V2000 0.7473 2.3057 5.1810 C 0 0 0 0 0 0 0 0 0 0 0 0 0.1483 0.9233 4.9686 C 0 0 0 0 0 0 0 0 0 0 0 0 0.2256 0.5024 3.5308 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.6870 0.7242 2.5206 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.2561 0.2012 1.2465 C 0 0 0 0 0 0 0 0 0 0 0 0 0.9890 -0.4001 1.3705 C 0 0 0 0 0 0 0 0 0 0 0 0 1.5787 -0.3636 2.9587 S 0 0 0 0 0 0 0 0 0 0 0 0 1.7114 -0.9844 0.3452 N 0 0 0 0 0 0 0 0 0 0 0 0 2.8525 -1.7664 0.4404 C 0 0 0 0 0 0 0 0 0 0 0 0 3.3007 -2.2453 1.4746 O 0 0 0 0 0 0 0 0 0 0 0 0 3.4227 -2.0592 -0.8615 C 0 0 0 0 0 0 0 0 0 0 0 0 4.5444 -2.7804 -1.2256 C 0 0 0 0 0 0 0 0 0 0 0 0 4.6071 -2.7452 -2.6397 C 0 0 0 0 0 0 0 0 0 0 0 0 3.5240 -2.0076 -3.0561 C 0 0 0 0 0 0 0 0 0 0 0 0 2.7919 -1.5907 -1.9892 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.1010 0.2713 -0.0095 C 0 0 1 0 0 0 0 0 0 0 0 0 -0.9058 1.6795 -0.5579 C 0 0 0 0 0 0 0 0 0 0 0 0 0.3322 2.1291 -1.0577 C 0 0 0 0 0 0 0 0 0 0 0 0 0.4702 3.4241 -1.5673 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.6228 4.2949 -1.5945 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.8592 3.8546 -1.1223 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.9997 2.5606 -0.6069 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.4521 5.9335 -2.2684 S 0 0 0 0 0 0 0 0 0 0 0 0 0.3058 6.7548 -0.8371 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.8177 -0.7096 -1.0772 N 0 0 0 0 0 0 0 0 0 0 0 0 -1.3880 -1.9749 -0.8911 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.2393 -2.5382 -1.8491 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.7599 -3.8239 -1.6627 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.4212 -4.5252 -0.5059 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.5460 -3.9488 0.4018 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.0593 -2.7205 0.1787 N 0 0 0 0 0 4 0 0 0 0 0 0 -3.7078 -4.4161 -2.6660 C 0 0 0 0 0 0 0 0 0 0 0 0 0.6731 2.5932 6.2353 H 0 0 0 0 0 0 0 0 0 0 0 0 1.8057 2.3300 4.8970 H 0 0 0 0 0 0 0 0 0 0 0 0 0.2220 3.0614 4.5851 H 0 0 0 0 0 0 0 0 0 0 0 0 0.6614 0.1973 5.6108 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9016 0.9329 5.2873 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.6199 1.2587 2.6821 H 0 0 0 0 0 0 0 0 0 0 0 0 1.3920 -0.8036 -0.6057 H 0 0 0 0 0 0 0 0 0 0 0 0 5.2255 -3.2729 -0.5446 H 0 0 0 0 0 0 0 0 0 0 0 0 5.3556 -3.2007 -3.2760 H 0 0 0 0 0 0 0 0 0 0 0 0 3.1555 -1.7073 -4.0291 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.1541 0.1593 0.2864 H 0 0 0 0 0 0 0 0 0 0 0 0 1.2109 1.4865 -1.0579 H 0 0 0 0 0 0 0 0 0 0 0 0 1.4397 3.7474 -1.9462 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.7236 4.5178 -1.1495 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.9828 2.2594 -0.2437 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.3917 6.7680 0.0062 H 0 0 0 0 0 0 0 0 0 0 0 0 1.2279 6.2458 -0.5386 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5537 7.7870 -1.1039 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.1299 -0.3124 -1.9663 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.5018 -1.9795 -2.7467 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.8182 -5.5226 -0.3208 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.2099 -4.4487 1.3065 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.3769 -2.3482 0.8329 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.4582 -4.0839 -3.6794 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.6489 -5.5097 -2.6588 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.7344 -4.1142 -2.4340 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 2 3 1 0 3 4 2 0 4 5 1 0 5 6 2 0 6 7 1 0 6 8 1 0 8 9 1 0 9 10 2 0 9 11 1 0 11 12 2 0 12 13 1 0 13 14 2 0 14 15 1 0 5 16 1 0 16 17 1 0 17 18 2 0 18 19 1 0 19 20 2 0 20 21 1 0 21 22 2 0 20 23 1 0 23 24 1 0 16 25 1 0 25 26 1 0 26 27 2 0 27 28 1 0 28 29 2 0 29 30 1 0 30 31 2 0 28 32 1 0 7 3 1 0 15 11 1 0 22 17 1 0 31 26 1 0 1 33 1 0 1 34 1 0 1 35 1 0 2 36 1 0 2 37 1 0 4 38 1 0 8 39 1 0 12 40 1 0 13 41 1 0 14 42 1 0 16 43 1 1 18 44 1 0 19 45 1 0 21 46 1 0 22 47 1 0 24 48 1 0 24 49 1 0 24 50 1 0 25 51 1 0 27 52 1 0 29 53 1 0 30 54 1 0 31 55 1 0 32 56 1 0 32 57 1 0 32 58 1 0 M CHG 1 31 1 M END