RDKit 3D 48 51 0 0 0 0 0 0 0 0999 V2000 -5.3783 -1.3482 -2.9723 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.4179 -1.3410 -1.9159 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.0338 -0.0584 -1.5550 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.8430 1.1234 -2.5042 S 0 0 0 0 0 0 0 0 0 0 0 0 -5.7090 -0.0724 -3.3787 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.0832 0.3413 -0.5551 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.0762 1.1703 -0.7860 N 0 0 0 0 0 0 0 0 0 0 0 0 -1.3764 1.3231 0.3777 N 0 0 0 0 0 0 0 0 0 0 0 0 -1.9724 0.5985 1.2994 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.0649 -0.0308 0.7704 N 0 0 0 0 0 0 0 0 0 0 0 0 -4.0569 -0.8460 1.4692 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.5518 -2.2475 1.7591 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.7416 -3.1543 1.4369 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.5445 -3.9625 0.4779 O 0 0 0 0 0 0 0 0 0 0 0 0 -5.7829 -2.9471 2.1425 O 0 0 0 0 0 1 0 0 0 0 0 0 -1.4439 0.4449 2.9350 S 0 0 0 0 0 0 0 0 0 0 0 0 -0.2518 1.8124 3.0496 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1401 1.3965 2.5840 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0304 1.1681 3.4042 O 0 0 0 0 0 0 0 0 0 0 0 0 1.2666 1.3422 1.2063 N 0 0 0 0 0 0 0 0 0 0 0 0 2.4192 1.0663 0.4473 C 0 0 0 0 0 0 0 0 0 0 0 0 2.2382 0.9363 -0.9463 C 0 0 0 0 0 0 0 0 0 0 0 0 3.3177 0.6850 -1.8007 C 0 0 0 0 0 0 0 0 0 0 0 0 4.5748 0.5518 -1.2410 C 0 0 0 0 0 0 0 0 0 0 0 0 4.7647 0.6777 0.1403 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7000 0.9394 0.9922 C 0 0 0 0 0 0 0 0 0 0 0 0 6.2129 0.5476 0.4936 C 0 0 0 0 0 0 0 0 0 0 0 0 6.7610 -0.1386 -0.7652 C 0 0 0 0 0 0 0 0 0 0 0 0 5.8774 0.3179 -1.9362 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.7992 -2.2489 -3.3928 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.0311 -2.2455 -1.4491 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.4066 0.2116 -4.1514 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.3069 -0.3197 2.3977 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.9726 -0.8297 0.8719 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.2869 -2.3578 2.8259 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.6709 -2.5232 1.1497 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.1777 2.1039 4.1038 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5887 2.7004 2.5010 H 0 0 0 0 0 0 0 0 0 0 0 0 0.4024 1.4236 0.6738 H 0 0 0 0 0 0 0 0 0 0 0 0 1.2428 1.0284 -1.3789 H 0 0 0 0 0 0 0 0 0 0 0 0 3.1596 0.5947 -2.8694 H 0 0 0 0 0 0 0 0 0 0 0 0 3.8864 1.0410 2.0542 H 0 0 0 0 0 0 0 0 0 0 0 0 6.6553 1.5389 0.6255 H 0 0 0 0 0 0 0 0 0 0 0 0 6.3768 -0.0602 1.3875 H 0 0 0 0 0 0 0 0 0 0 0 0 6.6676 -1.2275 -0.6493 H 0 0 0 0 0 0 0 0 0 0 0 0 7.8189 0.0767 -0.9319 H 0 0 0 0 0 0 0 0 0 0 0 0 6.2472 1.2543 -2.3751 H 0 0 0 0 0 0 0 0 0 0 0 0 5.8092 -0.4571 -2.7066 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 2 3 2 0 3 4 1 0 4 5 1 0 3 6 1 0 6 7 2 0 7 8 1 0 8 9 2 0 9 10 1 0 10 11 1 0 11 12 1 0 12 13 1 0 13 14 2 0 13 15 1 0 9 16 1 0 16 17 1 0 17 18 1 0 18 19 2 0 18 20 1 0 20 21 1 0 21 22 2 0 22 23 1 0 23 24 2 0 24 25 1 0 25 26 2 0 25 27 1 0 27 28 1 0 28 29 1 0 5 1 2 0 10 6 1 0 26 21 1 0 29 24 1 0 1 30 1 0 2 31 1 0 5 32 1 0 11 33 1 0 11 34 1 0 12 35 1 0 12 36 1 0 17 37 1 0 17 38 1 0 20 39 1 0 22 40 1 0 23 41 1 0 26 42 1 0 27 43 1 0 27 44 1 0 28 45 1 0 28 46 1 0 29 47 1 0 29 48 1 0 M CHG 1 15 -1 M END