RDKit 3D 42 45 0 0 0 0 0 0 0 0999 V2000 4.0254 -1.6323 -0.1108 C 0 0 0 0 0 0 0 0 0 0 0 0 2.7269 -1.6963 -0.3165 C 0 0 0 0 0 0 0 0 0 0 0 0 1.8858 -2.8875 -0.3891 C 0 0 0 0 0 0 0 0 0 0 0 0 2.2966 -4.0849 -0.3004 O 0 0 0 0 0 0 0 0 0 0 0 0 0.5548 -2.4585 -0.5733 O 0 0 0 0 0 0 0 0 0 0 0 0 0.4918 -1.1846 -0.0157 C 0 0 1 0 0 0 0 0 0 0 0 0 1.8040 -0.5669 -0.5246 C 0 0 1 0 0 0 0 0 0 0 0 0 2.0746 0.6302 0.3149 C 0 0 0 0 0 0 0 0 0 0 0 0 1.3765 1.8164 -0.3323 C 0 0 1 0 0 0 0 0 0 0 0 0 1.4147 1.7016 -1.7350 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.0046 2.0399 0.1455 C 0 0 1 0 0 0 0 0 0 0 0 0 0.0724 2.8576 1.4402 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.6614 2.8557 -0.8024 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.8390 0.8477 0.3770 C 0 0 1 0 0 0 0 0 0 0 0 0 -1.4616 0.7201 1.6064 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.2879 1.0031 0.4887 C 0 0 2 0 0 0 0 0 0 0 0 0 -2.9742 -0.2252 -0.0396 C 0 0 2 0 0 0 0 0 0 0 0 0 -3.5633 -0.8651 1.0709 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.8885 -1.0937 -0.6207 C 0 0 1 0 0 0 0 0 0 0 0 0 -1.8501 -2.4065 0.1206 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.2088 -1.3381 -1.9451 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.6099 -0.3149 -0.5085 C 0 0 2 0 0 0 0 0 0 0 0 0 4.5351 -0.6871 -0.0786 H 0 0 0 0 0 0 0 0 0 0 0 0 4.5970 -2.5300 0.0285 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5528 -1.2327 1.0978 H 0 0 0 0 0 0 0 0 0 0 0 0 1.6339 -0.3405 -1.5934 H 0 0 0 0 0 0 0 0 0 0 0 0 3.1574 0.8197 0.4493 H 0 0 0 0 0 0 0 0 0 0 0 0 1.6659 0.4601 1.3378 H 0 0 0 0 0 0 0 0 0 0 0 0 1.9941 2.7112 -0.0896 H 0 0 0 0 0 0 0 0 0 0 0 0 0.6289 2.1783 -2.0926 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.3873 3.8498 1.3258 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.4407 2.3317 2.2712 H 0 0 0 0 0 0 0 0 0 0 0 0 1.1236 3.0002 1.7650 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9414 3.7152 -0.4178 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.7931 1.9861 0.4574 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.7833 -0.0142 -0.7541 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.8997 -0.9978 1.8018 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.6584 -3.2710 -0.5715 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.8911 -2.6024 0.5119 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.1958 -2.4109 0.9920 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.9323 -0.7318 -2.2669 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.3397 0.0483 -1.5243 H 0 0 0 0 0 0 0 0 0 0 0 0 20 19 1 0 19 21 1 6 19 17 1 0 17 18 1 0 17 16 1 0 16 15 1 0 14 15 1 1 14 22 1 0 22 6 1 0 6 5 1 0 5 3 1 0 3 4 2 0 3 2 1 0 2 1 2 3 2 7 1 0 7 8 1 0 8 9 1 0 9 10 1 0 9 11 1 0 11 12 1 0 11 13 1 6 22 19 1 0 7 6 1 0 14 16 1 0 11 14 1 0 20 38 1 0 20 39 1 0 20 40 1 0 21 41 1 0 17 36 1 6 18 37 1 0 16 35 1 1 22 42 1 6 6 25 1 1 1 23 1 0 1 24 1 0 7 26 1 6 8 27 1 0 8 28 1 0 9 29 1 6 10 30 1 0 12 31 1 0 12 32 1 0 12 33 1 0 13 34 1 0 M END