RDKit 3D 47 50 0 0 0 0 0 0 0 0999 V2000 -1.9604 2.9731 0.7833 C 0 0 0 0 0 3 0 0 0 0 0 0 -1.7270 1.8541 0.5759 N 0 0 0 0 0 4 0 0 0 0 0 0 -1.4694 0.5189 0.3610 C 0 0 2 0 0 0 0 0 0 0 0 0 -0.4603 0.2691 -0.7399 C 0 0 1 0 0 0 0 0 0 0 0 0 0.5027 1.3527 -0.8042 C 0 0 0 0 0 0 0 0 0 0 0 0 0.3987 2.6731 -1.2012 C 0 0 0 0 0 0 0 0 0 0 0 0 1.6132 3.2434 -1.0354 N 0 0 0 0 0 0 0 0 0 0 0 0 2.4901 2.3264 -0.5461 C 0 0 0 0 0 0 0 0 0 0 0 0 3.8156 2.3024 -0.1898 C 0 0 0 0 0 0 0 0 0 0 0 0 4.3774 1.1242 0.2820 C 0 0 0 0 0 0 0 0 0 0 0 0 3.6103 -0.0456 0.4001 C 0 0 0 0 0 0 0 0 0 0 0 0 2.2795 -0.0082 0.0387 C 0 0 0 0 0 0 0 0 0 0 0 0 1.7776 1.1682 -0.4145 C 0 0 0 0 0 0 0 0 0 0 0 0 1.4394 -1.1969 0.1029 C 0 0 2 0 0 0 0 0 0 0 0 0 1.3692 -1.6357 1.5501 C 0 0 0 0 0 0 0 0 0 0 0 0 2.2571 -2.3149 -0.5820 C 0 0 0 0 0 0 0 0 0 0 0 0 0.1255 -1.0946 -0.5674 C 0 0 1 0 0 0 0 0 0 0 0 0 -0.8760 -1.9478 0.1821 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.3038 -1.6786 -0.1837 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.7248 -0.2486 -0.0798 C 0 0 2 0 0 0 0 0 0 0 0 0 -3.1970 0.2573 -1.4309 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.8209 0.0112 0.8748 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.6510 0.4834 2.0936 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.1648 0.0073 1.3058 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0581 0.3235 -1.6990 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.4663 3.1767 -1.5869 H 0 0 0 0 0 0 0 0 0 0 0 0 1.8724 4.2333 -1.2415 H 0 0 0 0 0 0 0 0 0 0 0 0 4.3954 3.2206 -0.2890 H 0 0 0 0 0 0 0 0 0 0 0 0 5.4138 1.1501 0.5489 H 0 0 0 0 0 0 0 0 0 0 0 0 4.1008 -0.9092 0.7684 H 0 0 0 0 0 0 0 0 0 0 0 0 1.1312 -2.7111 1.6650 H 0 0 0 0 0 0 0 0 0 0 0 0 0.8163 -0.9536 2.1887 H 0 0 0 0 0 0 0 0 0 0 0 0 2.4397 -1.5707 1.9204 H 0 0 0 0 0 0 0 0 0 0 0 0 1.8408 -2.4009 -1.6065 H 0 0 0 0 0 0 0 0 0 0 0 0 3.3078 -2.0611 -0.6944 H 0 0 0 0 0 0 0 0 0 0 0 0 2.1462 -3.2745 -0.0459 H 0 0 0 0 0 0 0 0 0 0 0 0 0.1994 -1.5439 -1.5858 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.6740 -3.0141 -0.1358 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.7100 -1.9651 1.2782 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.9348 -2.2955 0.4705 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.4501 -2.0346 -1.2264 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.3179 0.2397 -1.4705 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.8674 -0.4715 -2.2139 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.8910 1.2840 -1.6373 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.8746 -0.1881 0.5937 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.4676 0.6699 2.7862 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.6527 0.7022 2.4379 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 3 0 2 3 1 0 3 4 1 0 4 5 1 0 5 6 2 0 6 7 1 0 7 8 1 0 8 9 2 0 9 10 1 0 10 11 2 0 11 12 1 0 12 13 2 0 12 14 1 0 14 15 1 1 14 16 1 0 14 17 1 0 17 18 1 0 18 19 1 0 19 20 1 0 20 21 1 0 20 22 1 1 22 23 2 3 20 3 1 0 17 4 1 0 13 5 1 0 13 8 1 0 3 24 1 1 4 25 1 6 6 26 1 0 7 27 1 0 9 28 1 0 10 29 1 0 11 30 1 0 15 31 1 0 15 32 1 0 15 33 1 0 16 34 1 0 16 35 1 0 16 36 1 0 17 37 1 6 18 38 1 0 18 39 1 0 19 40 1 0 19 41 1 0 21 42 1 0 21 43 1 0 21 44 1 0 22 45 1 0 23 46 1 0 23 47 1 0 M CHG 2 1 -1 2 1 M END