RDKit 3D 53 54 0 0 0 0 0 0 0 0999 V2000 4.4351 0.4340 -3.3269 C 0 0 0 0 0 0 0 0 0 0 0 0 5.1831 1.5522 -2.9311 O 0 0 0 0 0 0 0 0 0 0 0 0 4.8972 2.1785 -1.7059 C 0 0 0 0 0 0 0 0 0 0 0 0 3.8767 1.6939 -0.8859 C 0 0 0 0 0 0 0 0 0 0 0 0 3.5491 2.2572 0.3160 C 0 0 0 0 0 0 0 0 0 0 0 0 2.4992 1.7692 1.1719 C 0 0 0 0 0 0 0 0 0 0 0 0 1.7685 0.7322 0.8526 C 0 0 0 0 0 0 0 0 0 0 0 0 0.6983 0.2258 1.7131 C 0 0 0 0 0 0 0 0 0 0 0 0 0.5155 0.8508 2.7860 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.1596 -0.9405 1.4111 C 0 0 1 0 0 0 0 0 0 0 0 0 -1.1028 -1.0014 2.4649 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.8160 -0.7885 0.1105 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0070 -0.6750 -0.8951 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.1982 -0.7425 -0.2512 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.1940 -0.8388 0.5892 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.5964 -0.7826 0.1418 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.9520 -0.6255 -1.1728 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.2915 -0.5798 -1.5424 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.2967 -0.6888 -0.6168 C 0 0 0 0 0 0 0 0 0 0 0 0 -8.6407 -0.6399 -1.0125 O 0 0 0 0 0 0 0 0 0 0 0 0 -6.9447 -0.8467 0.7042 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.9371 -0.9609 1.6710 O 0 0 0 0 0 0 0 0 0 0 0 0 -5.6273 -0.8934 1.0819 C 0 0 0 0 0 0 0 0 0 0 0 0 0.5870 -2.2515 1.5413 C 0 0 2 0 0 0 0 0 0 0 0 0 1.1722 -2.3073 2.7865 O 0 0 0 0 0 0 0 0 0 0 0 0 1.5814 -2.5544 0.4926 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0472 -3.8757 0.7607 O 0 0 0 0 0 0 0 0 0 0 0 0 4.3086 3.3765 0.6963 C 0 0 0 0 0 0 0 0 0 0 0 0 5.3214 3.8871 -0.0791 C 0 0 0 0 0 0 0 0 0 0 0 0 5.6053 3.2772 -1.2795 C 0 0 0 0 0 0 0 0 0 0 0 0 6.6204 3.7741 -2.0758 O 0 0 0 0 0 0 0 0 0 0 0 0 4.4553 -0.3422 -2.5390 H 0 0 0 0 0 0 0 0 0 0 0 0 4.9394 -0.0349 -4.2161 H 0 0 0 0 0 0 0 0 0 0 0 0 3.4299 0.7119 -3.6497 H 0 0 0 0 0 0 0 0 0 0 0 0 3.3418 0.8143 -1.2724 H 0 0 0 0 0 0 0 0 0 0 0 0 2.3002 2.2833 2.1297 H 0 0 0 0 0 0 0 0 0 0 0 0 1.9493 0.2309 -0.0742 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.6358 -1.2369 3.2971 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.4169 -0.6144 -1.3387 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.0595 -0.9645 1.6445 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.2124 -0.5304 -1.9738 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.5572 -0.4533 -2.6038 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.8543 -0.5228 -1.9910 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.8957 -0.9293 1.4127 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.3461 -1.0188 2.1325 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.1828 -3.0802 1.5092 H 0 0 0 0 0 0 0 0 0 0 0 0 1.8154 -1.5296 2.8271 H 0 0 0 0 0 0 0 0 0 0 0 0 2.5161 -1.9550 0.5585 H 0 0 0 0 0 0 0 0 0 0 0 0 1.2406 -2.5811 -0.5350 H 0 0 0 0 0 0 0 0 0 0 0 0 2.4506 -4.2241 -0.0760 H 0 0 0 0 0 0 0 0 0 0 0 0 4.0360 3.8102 1.6509 H 0 0 0 0 0 0 0 0 0 0 0 0 5.8838 4.7637 0.2651 H 0 0 0 0 0 0 0 0 0 0 0 0 6.8862 3.3878 -2.9579 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 4 5 1 0 5 6 1 0 6 7 2 0 7 8 1 0 8 9 2 0 8 10 1 0 10 11 1 1 10 24 1 0 24 25 1 0 24 26 1 0 26 27 1 0 10 12 1 0 12 13 2 0 12 14 1 0 14 15 2 0 15 16 1 0 16 17 2 0 17 18 1 0 18 19 2 0 19 20 1 0 19 21 1 0 21 22 1 0 21 23 2 0 5 28 2 0 28 29 1 0 29 30 2 0 30 31 1 0 30 3 1 0 23 16 1 0 1 32 1 0 1 33 1 0 1 34 1 0 4 35 1 0 6 36 1 0 7 37 1 0 11 38 1 0 24 46 1 1 25 47 1 0 26 48 1 0 26 49 1 0 27 50 1 0 14 39 1 0 15 40 1 0 17 41 1 0 18 42 1 0 20 43 1 0 22 44 1 0 23 45 1 0 28 51 1 0 29 52 1 0 31 53 1 0 M END