RDKit 3D 40 42 0 0 0 0 0 0 0 0999 V2000 -2.5299 -0.7201 3.4338 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.3738 -1.1305 2.2122 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.3867 -1.8538 1.4316 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.5300 -2.2492 1.8407 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.8951 -2.0460 0.1465 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.9763 -0.9977 -0.0557 C 0 0 1 0 0 0 0 0 0 0 0 0 -1.2224 -1.0171 1.2826 C 0 0 1 0 0 0 0 0 0 0 0 0 -0.4142 0.2283 1.4438 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0476 0.0134 1.4253 C 0 0 0 0 0 0 0 0 0 0 0 0 1.8499 0.8656 0.5527 C 0 0 0 0 0 0 0 0 0 0 0 0 1.8514 2.1555 0.8356 C 0 0 0 0 0 0 0 0 0 0 0 0 2.6611 0.4367 -0.6128 C 0 0 2 0 0 0 0 0 0 0 0 0 3.0930 1.5007 -1.3837 O 0 0 0 0 0 0 0 0 0 0 0 0 4.3753 1.6163 -1.4909 O 0 0 0 0 0 0 0 0 0 0 0 0 1.9185 -0.5972 -1.4723 C 0 0 0 0 0 0 0 0 0 0 0 0 0.8399 0.0188 -2.2869 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.5478 -0.1699 -1.8165 C 0 0 1 0 0 0 0 0 0 0 0 0 -1.4776 1.0004 -2.0906 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.2580 -1.3449 -2.4459 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.9555 -1.2962 -1.1134 C 0 0 2 0 0 0 0 0 0 0 0 0 -3.4554 -0.9007 3.9506 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.7528 -0.2023 3.9443 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.4336 -0.0067 -0.1136 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.6532 -1.9428 1.3218 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.6943 0.6641 2.4440 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.7885 0.9712 0.7160 H 0 0 0 0 0 0 0 0 0 0 0 0 1.2426 -1.0454 1.1550 H 0 0 0 0 0 0 0 0 0 0 0 0 1.4853 0.1132 2.4647 H 0 0 0 0 0 0 0 0 0 0 0 0 2.4114 2.8744 0.2551 H 0 0 0 0 0 0 0 0 0 0 0 0 1.2819 2.5217 1.6687 H 0 0 0 0 0 0 0 0 0 0 0 0 3.5823 -0.0764 -0.2625 H 0 0 0 0 0 0 0 0 0 0 0 0 4.7463 2.4511 -1.1556 H 0 0 0 0 0 0 0 0 0 0 0 0 1.6333 -1.4034 -0.8036 H 0 0 0 0 0 0 0 0 0 0 0 0 2.6471 -1.0691 -2.1980 H 0 0 0 0 0 0 0 0 0 0 0 0 0.8957 -0.2966 -3.3697 H 0 0 0 0 0 0 0 0 0 0 0 0 1.0687 1.1261 -2.3370 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.3068 1.2642 -3.1726 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.1771 1.9038 -1.5279 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.5379 0.7550 -2.0030 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.2646 -2.1147 -0.8129 H 0 0 0 0 0 0 0 0 0 0 0 0 17 18 1 1 17 16 1 0 16 15 1 0 15 12 1 0 12 13 1 0 13 14 1 0 12 10 1 0 10 11 2 3 10 9 1 0 9 8 1 0 8 7 1 0 7 6 1 0 6 5 1 0 5 3 1 0 3 4 2 0 3 2 1 0 2 1 2 3 6 20 1 0 20 19 1 0 20 17 1 0 19 17 1 0 2 7 1 0 18 37 1 0 18 38 1 0 18 39 1 0 16 35 1 0 16 36 1 0 15 33 1 0 15 34 1 0 12 31 1 1 14 32 1 0 11 29 1 0 11 30 1 0 9 27 1 0 9 28 1 0 8 25 1 0 8 26 1 0 7 24 1 6 6 23 1 6 1 21 1 0 1 22 1 0 20 40 1 1 M END