RDKit 3D 40 40 0 0 0 0 0 0 0 0999 V2000 -0.3809 -0.4653 -2.4825 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0073 -0.5808 -2.3867 C 0 0 0 0 0 0 0 0 0 0 0 0 1.6343 -0.6367 -1.1406 C 0 0 0 0 0 0 0 0 0 0 0 0 0.8496 -0.5857 0.0105 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.5481 -0.4717 -0.0847 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.1671 -0.4027 -1.3320 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.5078 -0.2793 -1.5662 O 0 0 0 0 0 0 0 0 0 0 0 0 -3.3632 -0.0761 -0.4226 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.7712 0.2088 -0.9718 C 0 0 1 0 0 0 0 0 0 0 0 0 -5.7772 0.6652 0.0693 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.0942 -0.5446 1.3211 S 0 0 0 0 0 0 0 0 0 0 0 0 -4.8691 -0.5345 2.1167 O 0 0 0 0 0 0 0 0 0 0 0 0 -6.3293 -1.7713 0.5643 O 0 0 0 0 0 0 0 0 0 0 0 0 -7.2699 -0.0128 2.0072 O 0 0 0 0 0 1 0 0 0 0 0 0 -4.6653 1.2564 -1.9722 O 0 0 0 0 0 0 0 0 0 0 0 0 2.9938 -0.7430 -1.2049 O 0 0 0 0 0 0 0 0 0 0 0 0 3.7671 -0.7020 0.0073 C 0 0 0 0 0 0 0 0 0 0 0 0 4.0347 0.7493 0.4439 C 0 0 1 0 0 0 0 0 0 0 0 0 4.5713 0.8989 1.8647 C 0 0 0 0 0 0 0 0 0 0 0 0 6.0458 -0.0418 2.1634 S 0 0 0 0 0 0 0 0 0 0 0 0 6.5589 0.5199 3.4096 O 0 0 0 0 0 0 0 0 0 0 0 0 5.5605 -1.4149 2.2632 O 0 0 0 0 0 0 0 0 0 0 0 0 6.8576 0.2398 0.9782 O 0 0 0 0 0 1 0 0 0 0 0 0 4.9098 1.4070 -0.4949 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.8494 -0.4212 -3.4612 H 0 0 0 0 0 0 0 0 0 0 0 0 1.6092 -0.6227 -3.2904 H 0 0 0 0 0 0 0 0 0 0 0 0 1.2843 -0.6360 1.0030 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.1236 -0.4464 0.8368 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.3545 -0.9802 0.1924 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.0091 0.7938 0.1433 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.1341 -0.6748 -1.5089 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.7332 0.8845 -0.4208 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.4564 1.5908 0.5600 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.8627 1.0257 -2.4797 H 0 0 0 0 0 0 0 0 0 0 0 0 4.7131 -1.1891 -0.2524 H 0 0 0 0 0 0 0 0 0 0 0 0 3.2989 -1.3054 0.7914 H 0 0 0 0 0 0 0 0 0 0 0 0 3.0985 1.3152 0.3869 H 0 0 0 0 0 0 0 0 0 0 0 0 3.8283 0.5890 2.6065 H 0 0 0 0 0 0 0 0 0 0 0 0 4.8344 1.9471 2.0474 H 0 0 0 0 0 0 0 0 0 0 0 0 5.8089 1.0349 -0.3147 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 2 0 2 3 1 0 3 4 2 0 4 5 1 0 5 6 2 0 6 7 1 0 7 8 1 0 8 9 1 0 9 10 1 0 10 11 1 0 11 12 2 0 11 13 2 0 11 14 1 0 9 15 1 0 3 16 1 0 16 17 1 0 17 18 1 0 18 19 1 0 19 20 1 0 20 21 2 0 20 22 2 0 20 23 1 0 18 24 1 0 6 1 1 0 1 25 1 0 2 26 1 0 4 27 1 0 5 28 1 0 8 29 1 0 8 30 1 0 9 31 1 6 10 32 1 0 10 33 1 0 15 34 1 0 17 35 1 0 17 36 1 0 18 37 1 1 19 38 1 0 19 39 1 0 24 40 1 0 M CHG 2 14 -1 23 -1 M END