RDKit 3D 51 55 0 0 0 0 0 0 0 0999 V2000 -3.8537 3.6810 2.0728 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.9884 2.5717 1.1749 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.8651 2.0119 0.6134 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.7404 2.4678 0.8850 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.9541 0.8739 -0.3120 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.1742 0.3850 -0.6029 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.2048 -0.6848 -1.4754 O 0 0 0 0 0 0 0 0 0 0 0 0 -3.2486 -1.7147 -1.2240 C 0 0 1 0 0 0 0 0 0 0 0 0 -3.4399 -2.8375 -2.2344 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.8489 -1.2057 -1.2064 C 0 0 2 0 0 0 0 0 0 0 0 0 -1.0862 -1.9534 -0.1044 C 0 0 0 0 0 0 0 0 0 0 0 0 0.3615 -1.7744 -0.3159 N 0 0 2 0 0 4 0 0 0 0 0 0 0.6829 -2.6368 -1.3139 O 0 0 0 0 0 1 0 0 0 0 0 0 1.0562 -2.1437 0.8511 C 0 0 0 0 0 0 0 0 0 0 0 0 1.7428 -1.0658 1.6033 C 0 0 0 0 0 0 0 0 0 0 0 0 2.4967 -0.2121 0.6717 C 0 0 0 0 0 0 0 0 0 0 0 0 1.8884 0.1111 -0.5222 C 0 0 0 0 0 0 0 0 0 0 0 0 2.7036 0.8781 -1.2268 N 0 0 0 0 0 0 0 0 0 0 0 0 3.8345 1.0632 -0.5167 C 0 0 0 0 0 0 0 0 0 0 0 0 5.0117 1.7500 -0.7262 C 0 0 0 0 0 0 0 0 0 0 0 0 6.0179 1.7541 0.2141 C 0 0 0 0 0 0 0 0 0 0 0 0 5.8763 1.0671 1.4000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.7097 0.3699 1.6395 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7288 0.3882 0.6801 C 0 0 0 0 0 0 0 0 0 0 0 0 0.5304 -0.4258 -0.7710 C 0 0 2 0 0 0 0 0 0 0 0 0 -0.5013 0.5396 -0.2144 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.7996 0.2527 -0.9471 C 0 0 2 0 0 0 0 0 0 0 0 0 -2.7654 3.8616 2.2781 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.4106 3.4037 2.9842 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.2286 4.6195 1.6153 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.0557 0.8461 -0.1480 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.4567 -2.1954 -0.2336 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.9327 -3.7438 -1.8605 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.1707 -2.5534 -3.2510 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.5394 -3.0647 -2.2255 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.2979 -1.4857 -2.1570 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.4004 -1.6377 0.8899 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.2783 -3.0367 -0.2111 H 0 0 0 0 0 0 0 0 0 0 0 0 0.3581 -2.6599 1.5759 H 0 0 0 0 0 0 0 0 0 0 0 0 1.8284 -2.9410 0.6347 H 0 0 0 0 0 0 0 0 0 0 0 0 2.5009 -1.5583 2.2810 H 0 0 0 0 0 0 0 0 0 0 0 0 1.0886 -0.4940 2.3009 H 0 0 0 0 0 0 0 0 0 0 0 0 2.5688 1.3080 -2.1795 H 0 0 0 0 0 0 0 0 0 0 0 0 5.1498 2.2968 -1.6461 H 0 0 0 0 0 0 0 0 0 0 0 0 6.9230 2.3043 0.0103 H 0 0 0 0 0 0 0 0 0 0 0 0 6.6787 1.0712 2.1482 H 0 0 0 0 0 0 0 0 0 0 0 0 4.5492 -0.1870 2.5577 H 0 0 0 0 0 0 0 0 0 0 0 0 0.3893 -0.4153 -1.8715 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.6023 0.4440 0.8841 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.1603 1.5479 -0.5151 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.6720 0.7592 -1.9537 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 2 3 1 0 3 4 2 0 3 5 1 0 5 6 2 0 6 7 1 0 7 8 1 0 8 9 1 0 8 10 1 0 10 11 1 0 11 12 1 0 12 13 1 6 12 14 1 0 14 15 1 0 15 16 1 0 16 17 2 0 17 18 1 0 18 19 1 0 19 20 2 0 20 21 1 0 21 22 2 0 22 23 1 0 23 24 2 0 17 25 1 0 25 26 1 0 26 27 1 0 27 5 1 0 27 10 1 0 25 12 1 0 24 16 1 0 24 19 1 0 1 28 1 0 1 29 1 0 1 30 1 0 6 31 1 0 8 32 1 1 9 33 1 0 9 34 1 0 9 35 1 0 10 36 1 6 11 37 1 0 11 38 1 0 14 39 1 0 14 40 1 0 15 41 1 0 15 42 1 0 18 43 1 0 20 44 1 0 21 45 1 0 22 46 1 0 23 47 1 0 25 48 1 6 26 49 1 0 26 50 1 0 27 51 1 6 M CHG 2 12 1 13 -1 M END