RDKit 3D 44 44 0 0 0 0 0 0 0 0999 V2000 -2.1449 -1.7939 -0.4265 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.2278 -0.3612 0.0374 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.0055 0.0581 1.0581 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.9603 1.5122 1.3813 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.6044 1.9981 2.3049 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.1567 2.2714 0.5937 N 0 0 0 0 0 0 0 0 0 0 0 0 -1.4276 1.7278 -0.4066 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.4279 0.4784 -0.7070 N 0 0 0 0 0 0 0 0 0 0 0 0 -0.4682 2.9064 -1.2451 S 0 0 0 0 0 0 0 0 0 0 0 0 0.2690 1.8702 -2.5473 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2878 0.8637 -2.0297 C 0 0 0 0 0 0 0 0 0 0 0 0 1.5025 -0.1980 -2.6134 O 0 0 0 0 0 0 0 0 0 0 0 0 2.0292 1.2624 -0.9389 N 0 0 0 0 0 0 0 0 0 0 0 0 3.0016 0.3894 -0.3116 C 0 0 0 0 0 0 0 0 0 0 0 0 4.3134 0.2983 -1.1003 C 0 0 0 0 0 0 0 0 0 0 0 0 5.2713 -0.6083 -0.4945 N 0 0 0 0 0 0 0 0 0 0 0 0 5.9579 -0.2748 0.6488 C 0 0 0 0 0 0 0 0 0 0 0 0 5.8232 0.7951 1.2332 O 0 0 0 0 0 0 0 0 0 0 0 0 6.8709 -1.3592 1.1520 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.8870 -0.7840 1.9478 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.3763 -0.6330 1.6488 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.7469 -1.2270 0.3219 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.0319 -0.6126 -0.6909 O 0 0 0 0 0 0 0 0 0 0 0 0 -5.7381 -2.5727 0.3303 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.2969 -1.8457 -1.5103 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.8894 -2.4498 0.0274 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.1538 -2.2018 -0.2017 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.1075 3.2605 0.7776 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5211 1.3407 -3.0890 H 0 0 0 0 0 0 0 0 0 0 0 0 0.7845 2.5266 -3.2552 H 0 0 0 0 0 0 0 0 0 0 0 0 1.7667 2.1188 -0.4651 H 0 0 0 0 0 0 0 0 0 0 0 0 3.1794 0.7795 0.6956 H 0 0 0 0 0 0 0 0 0 0 0 0 2.5572 -0.6073 -0.2055 H 0 0 0 0 0 0 0 0 0 0 0 0 4.7726 1.2914 -1.1733 H 0 0 0 0 0 0 0 0 0 0 0 0 4.1360 -0.0592 -2.1195 H 0 0 0 0 0 0 0 0 0 0 0 0 5.3302 -1.5512 -0.8576 H 0 0 0 0 0 0 0 0 0 0 0 0 6.3295 -1.9817 1.8688 H 0 0 0 0 0 0 0 0 0 0 0 0 7.2341 -1.9814 0.3287 H 0 0 0 0 0 0 0 0 0 0 0 0 7.7368 -0.9035 1.6412 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.7086 -0.4954 2.9920 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.6025 -1.8402 1.9037 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.9719 -1.1330 2.4219 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.6883 0.4175 1.6539 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.0103 -2.8172 -0.5799 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 2 0 4 6 1 0 6 7 1 0 7 8 2 0 7 9 1 0 9 10 1 0 10 11 1 0 11 12 2 0 11 13 1 0 13 14 1 0 14 15 1 0 15 16 1 0 16 17 1 0 17 18 2 0 17 19 1 0 3 20 1 0 20 21 1 0 21 22 1 0 22 23 2 0 22 24 1 0 8 2 1 0 1 25 1 0 1 26 1 0 1 27 1 0 6 28 1 0 10 29 1 0 10 30 1 0 13 31 1 0 14 32 1 0 14 33 1 0 15 34 1 0 15 35 1 0 16 36 1 0 19 37 1 0 19 38 1 0 19 39 1 0 20 40 1 0 20 41 1 0 21 42 1 0 21 43 1 0 24 44 1 0 M END