RDKit 3D 51 52 0 0 0 0 0 0 0 0999 V2000 1.2051 -1.8076 -0.7840 C 0 0 0 0 0 0 0 0 0 0 0 0 0.5843 -0.6871 -0.4718 C 0 0 0 0 0 0 0 0 0 0 0 0 1.4027 0.4299 0.1238 C 0 0 0 0 0 0 0 0 0 0 0 0 2.7883 0.0553 0.2247 O 0 0 0 0 0 0 0 0 0 0 0 0 3.5336 -0.0780 -0.9345 C 0 0 0 0 0 0 0 0 0 0 0 0 2.8555 0.1952 -2.0305 O 0 0 0 0 0 0 0 0 0 0 0 0 4.9109 -0.4656 -1.1239 C 0 0 0 0 0 0 0 0 0 0 0 0 5.6176 -1.1136 0.0189 C 0 0 0 0 0 0 0 0 0 0 0 0 5.6478 -0.2036 1.2278 C 0 0 0 0 0 0 0 0 0 0 0 0 7.0993 -1.2652 -0.4265 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.8386 -0.4778 -0.7880 C 0 0 2 0 0 0 0 0 0 0 0 0 -0.9042 -0.0818 -2.1345 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.4799 0.4887 0.1378 C 0 0 1 0 0 0 0 0 0 0 0 0 -0.9428 1.7514 0.0818 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.9081 0.4654 0.1970 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.6410 1.5469 -0.3349 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.9169 2.5038 -1.0076 O 0 0 0 0 0 0 0 0 0 0 0 0 -3.6391 3.5840 -1.5938 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.0051 1.6223 -0.1833 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.6579 0.6074 0.5025 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.9638 -0.4773 1.0394 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.6738 -1.4383 1.7255 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.9761 -2.5234 2.2867 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.6152 -2.5346 2.0990 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.9611 -3.5057 2.6051 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.9593 -1.5747 1.4221 O 0 0 0 0 0 0 0 0 0 0 0 0 -3.5800 -0.5372 0.8813 C 0 0 0 0 0 0 0 0 0 0 0 0 0.6074 -2.5913 -1.2985 H 0 0 0 0 0 0 0 0 0 0 0 0 2.2155 -2.0063 -0.5654 H 0 0 0 0 0 0 0 0 0 0 0 0 1.3458 1.3530 -0.4174 H 0 0 0 0 0 0 0 0 0 0 0 0 1.0686 0.5151 1.1928 H 0 0 0 0 0 0 0 0 0 0 0 0 5.4878 0.4929 -1.3540 H 0 0 0 0 0 0 0 0 0 0 0 0 5.0477 -1.1567 -2.0108 H 0 0 0 0 0 0 0 0 0 0 0 0 5.2691 -2.1291 0.2653 H 0 0 0 0 0 0 0 0 0 0 0 0 6.6630 -0.2124 1.7247 H 0 0 0 0 0 0 0 0 0 0 0 0 5.4572 0.8470 0.8906 H 0 0 0 0 0 0 0 0 0 0 0 0 4.8476 -0.5061 1.9019 H 0 0 0 0 0 0 0 0 0 0 0 0 7.2375 -2.0963 -1.1155 H 0 0 0 0 0 0 0 0 0 0 0 0 7.7450 -1.4055 0.4590 H 0 0 0 0 0 0 0 0 0 0 0 0 7.4574 -0.3174 -0.9118 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.3019 -1.4830 -0.6543 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.3221 0.7142 -2.2594 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.1492 0.0772 1.2025 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.6423 2.1034 0.9822 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.9375 4.2980 -2.1472 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.2393 3.1001 -2.4342 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.3599 4.0810 -0.9453 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.5647 2.4504 -0.6117 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.7432 0.6668 0.6194 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.7267 -1.4337 1.8770 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.4447 -3.3119 2.8500 H 0 0 0 0 0 0 0 0 0 0 0 0 18 17 1 0 17 16 1 0 16 19 2 0 19 20 1 0 20 21 2 0 21 22 1 0 22 23 2 0 23 24 1 0 24 25 2 0 24 26 1 0 26 27 1 0 27 15 2 0 15 13 1 0 13 14 1 0 13 11 1 0 11 12 1 0 11 2 1 0 2 1 2 3 2 3 1 0 3 4 1 0 4 5 1 0 5 6 2 0 5 7 1 0 7 8 1 0 8 9 1 0 8 10 1 0 15 16 1 0 27 21 1 0 18 45 1 0 18 46 1 0 18 47 1 0 19 48 1 0 20 49 1 0 22 50 1 0 23 51 1 0 13 43 1 1 14 44 1 0 11 41 1 6 12 42 1 0 1 28 1 0 1 29 1 0 3 30 1 0 3 31 1 0 7 32 1 0 7 33 1 0 8 34 1 0 9 35 1 0 9 36 1 0 9 37 1 0 10 38 1 0 10 39 1 0 10 40 1 0 M END