RDKit 3D 45 48 0 0 0 0 0 0 0 0999 V2000 5.8049 -3.0485 0.0185 C 0 0 0 0 0 0 0 0 0 0 0 0 4.6400 -2.1216 -0.1530 C 0 0 0 0 0 0 0 0 0 0 0 0 3.4310 -2.3611 0.5023 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3332 -1.5081 0.3159 C 0 0 0 0 0 0 0 0 0 0 0 0 2.4032 -0.3958 -0.5317 C 0 0 0 0 0 0 0 0 0 0 0 0 3.6217 -0.1895 -1.2030 C 0 0 0 0 0 0 0 0 0 0 0 0 4.7238 -1.0327 -1.0204 C 0 0 0 0 0 0 0 0 0 0 0 0 1.3265 0.4732 -0.7667 N 0 0 0 0 0 0 0 0 0 0 0 0 0.1429 0.5003 0.0802 C 0 0 1 0 0 0 0 0 0 0 0 0 -0.6073 1.6421 -0.5820 C 0 0 2 0 0 0 0 0 0 0 0 0 0.5674 2.4947 -0.7416 C 0 0 0 0 0 0 0 0 0 0 0 0 1.6664 1.8295 -0.9724 N 0 0 0 0 0 0 0 0 0 0 0 0 0.4776 3.9822 -0.7669 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0656 4.5420 0.1725 O 0 0 0 0 0 0 0 0 0 0 0 0 1.0476 4.6676 -1.9692 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.7917 1.6555 0.2808 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.3992 2.6333 0.6688 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.1008 0.2988 0.4165 N 0 0 0 0 0 0 0 0 0 0 0 0 -0.9742 -0.4914 0.1378 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.8951 -1.7073 0.1420 O 0 0 0 0 0 0 0 0 0 0 0 0 -3.3297 -0.2176 0.9101 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.9711 0.4547 1.9662 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.1319 -0.0581 2.5591 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.6891 -1.2490 2.1040 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.1040 -1.9174 1.0320 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.9411 -1.3970 0.4332 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.5279 -2.0163 -0.8262 N 0 0 0 0 0 4 0 0 0 0 0 0 -3.1843 -1.2547 -1.7442 O 0 0 0 0 0 0 0 0 0 0 0 0 -3.6116 -3.2486 -0.9129 O 0 0 0 0 0 1 0 0 0 0 0 0 5.8241 -3.7810 -0.7937 H 0 0 0 0 0 0 0 0 0 0 0 0 6.7461 -2.4899 0.0150 H 0 0 0 0 0 0 0 0 0 0 0 0 5.7467 -3.5838 0.9721 H 0 0 0 0 0 0 0 0 0 0 0 0 3.3249 -3.2200 1.1618 H 0 0 0 0 0 0 0 0 0 0 0 0 1.4269 -1.7556 0.8568 H 0 0 0 0 0 0 0 0 0 0 0 0 3.7180 0.6459 -1.8934 H 0 0 0 0 0 0 0 0 0 0 0 0 5.6420 -0.8300 -1.5665 H 0 0 0 0 0 0 0 0 0 0 0 0 0.4341 0.7314 1.1197 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9518 1.4024 -1.6021 H 0 0 0 0 0 0 0 0 0 0 0 0 0.9789 5.7509 -1.8360 H 0 0 0 0 0 0 0 0 0 0 0 0 2.0998 4.3983 -2.0949 H 0 0 0 0 0 0 0 0 0 0 0 0 0.4750 4.3832 -2.8561 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.5619 1.3746 2.3819 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.5957 0.4765 3.3865 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.5921 -1.6420 2.5677 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.5768 -2.8202 0.6482 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 5 6 1 0 6 7 2 0 5 8 1 0 8 9 1 0 9 10 1 0 10 11 1 0 11 12 2 0 11 13 1 0 13 14 2 0 13 15 1 0 10 16 1 0 16 17 2 0 16 18 1 0 18 19 1 0 19 20 2 0 18 21 1 0 21 22 2 0 22 23 1 0 23 24 2 0 24 25 1 0 25 26 2 0 26 27 1 0 27 28 2 0 27 29 1 0 7 2 1 0 12 8 1 0 19 9 1 0 26 21 1 0 1 30 1 0 1 31 1 0 1 32 1 0 3 33 1 0 4 34 1 0 6 35 1 0 7 36 1 0 9 37 1 1 10 38 1 6 15 39 1 0 15 40 1 0 15 41 1 0 22 42 1 0 23 43 1 0 24 44 1 0 25 45 1 0 M CHG 2 27 1 29 -1 M END