RDKit 3D 81 85 0 0 0 0 0 0 0 0999 V2000 8.0665 0.6219 0.5103 C 0 0 0 0 0 0 0 0 0 0 0 0 7.7870 -0.8088 0.3652 C 0 0 0 0 0 0 0 0 0 0 0 0 8.7713 -1.8128 0.8338 C 0 0 0 0 0 0 0 0 0 0 0 0 6.6674 -1.2303 -0.1769 C 0 0 0 0 0 0 0 0 0 0 0 0 5.6806 -0.2101 -0.6448 C 0 0 1 0 0 0 0 0 0 0 0 0 4.3698 -0.8431 -1.0233 C 0 0 0 0 0 0 0 0 0 0 0 0 3.4089 0.3055 -0.6451 C 0 0 1 0 0 0 0 0 0 0 0 0 2.0959 -0.3348 -0.4649 C 0 0 2 0 0 0 0 0 0 0 0 0 1.7542 -0.9609 -1.8027 C 0 0 0 0 0 0 0 0 0 0 0 0 0.2476 -1.0274 -1.7073 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0807 0.3583 -1.1771 C 0 0 1 0 0 0 0 0 0 0 0 0 0.2255 1.3000 -2.3292 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.4818 0.4577 -0.7306 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.3439 1.1901 -1.3612 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.7977 1.3488 -0.9682 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.2155 0.0127 -0.4128 C 0 0 2 0 0 0 0 0 0 0 0 0 -5.6767 -0.0461 -0.1128 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.3081 1.2068 -0.7528 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.3838 -1.2236 -0.7556 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.0740 0.0026 1.3220 C 0 0 2 0 0 0 0 0 0 0 0 0 -7.2633 0.7768 1.4692 O 0 0 0 0 0 0 0 0 0 0 0 0 -5.0359 0.7002 2.1228 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.7763 -0.1228 2.0595 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.3276 -0.5096 0.6870 C 0 0 1 0 0 0 0 0 0 0 0 0 -3.5710 -2.0497 0.6195 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.8794 -0.3236 0.4568 C 0 0 2 0 0 0 0 0 0 0 0 0 -1.0299 0.1876 1.5788 C 0 0 0 0 0 0 0 0 0 0 0 0 0.4213 0.2435 1.2943 C 0 0 0 0 0 0 0 0 0 0 0 0 0.9290 0.5221 -0.0621 C 0 0 1 0 0 0 0 0 0 0 0 0 1.3178 2.0139 -0.0405 C 0 0 0 0 0 0 0 0 0 0 0 0 4.1028 0.7832 0.5942 C 0 0 1 0 0 0 0 0 0 0 0 0 3.9389 -0.1286 1.6085 O 0 0 0 0 0 0 0 0 0 0 0 0 5.4805 0.7843 0.2691 O 0 0 0 0 0 0 0 0 0 0 0 0 7.7772 1.2277 -0.3750 H 0 0 0 0 0 0 0 0 0 0 0 0 9.1588 0.7639 0.7435 H 0 0 0 0 0 0 0 0 0 0 0 0 7.5303 1.0994 1.3818 H 0 0 0 0 0 0 0 0 0 0 0 0 9.7579 -1.3289 0.8853 H 0 0 0 0 0 0 0 0 0 0 0 0 8.5348 -2.1731 1.8669 H 0 0 0 0 0 0 0 0 0 0 0 0 8.7686 -2.7382 0.2118 H 0 0 0 0 0 0 0 0 0 0 0 0 6.4082 -2.2738 -0.3088 H 0 0 0 0 0 0 0 0 0 0 0 0 6.1295 0.2411 -1.5744 H 0 0 0 0 0 0 0 0 0 0 0 0 4.1388 -1.7414 -0.4140 H 0 0 0 0 0 0 0 0 0 0 0 0 4.3550 -1.0340 -2.0997 H 0 0 0 0 0 0 0 0 0 0 0 0 3.5050 0.9971 -1.4980 H 0 0 0 0 0 0 0 0 0 0 0 0 2.2131 -1.1325 0.3114 H 0 0 0 0 0 0 0 0 0 0 0 0 2.1308 -0.3885 -2.6651 H 0 0 0 0 0 0 0 0 0 0 0 0 2.1865 -1.9932 -1.7723 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0480 -1.8469 -1.0104 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.1846 -1.1922 -2.7192 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.1256 0.9087 -3.2989 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.1497 2.3102 -2.2148 H 0 0 0 0 0 0 0 0 0 0 0 0 1.3399 1.4252 -2.4459 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.0097 1.7287 -2.2477 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.8929 2.1967 -0.3015 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.3694 1.5091 -1.9062 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.0698 -0.6746 -1.3001 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.3845 1.1572 -0.4058 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.3577 1.1484 -1.8393 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.9200 2.1312 -0.3194 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.1219 -0.9231 -1.5306 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.6011 -1.8082 -1.2822 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.8995 -1.8479 0.0164 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.3637 -1.0002 1.6735 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.5490 0.7889 2.4091 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.3122 0.7450 3.2051 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.9475 1.7284 1.7569 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.9617 0.3722 2.6782 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.0052 -1.0141 2.7236 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.8176 -2.5094 1.2964 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.6045 -2.2563 0.8455 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.3729 -2.2839 -0.4615 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.4439 -1.3712 0.2575 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.3596 1.2136 1.8282 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.1721 -0.4094 2.5024 H 0 0 0 0 0 0 0 0 0 0 0 0 0.8769 0.9299 2.0736 H 0 0 0 0 0 0 0 0 0 0 0 0 0.8533 -0.7603 1.5996 H 0 0 0 0 0 0 0 0 0 0 0 0 2.1415 2.2635 -0.6866 H 0 0 0 0 0 0 0 0 0 0 0 0 1.5695 2.3213 0.9973 H 0 0 0 0 0 0 0 0 0 0 0 0 0.4509 2.6509 -0.3134 H 0 0 0 0 0 0 0 0 0 0 0 0 3.8891 1.8050 0.9010 H 0 0 0 0 0 0 0 0 0 0 0 0 3.2132 0.2135 2.2028 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 2 3 1 0 2 4 2 3 4 5 1 0 5 6 1 0 6 7 1 0 7 31 1 0 31 32 1 0 31 33 1 0 7 8 1 0 8 9 1 0 9 10 1 0 10 11 1 0 11 12 1 6 11 13 1 0 13 14 2 0 14 15 1 0 15 16 1 0 16 17 1 0 17 18 1 0 17 19 1 0 17 20 1 0 20 21 1 0 20 22 1 0 22 23 1 0 23 24 1 0 24 25 1 1 24 26 1 0 26 27 1 0 27 28 1 0 28 29 1 0 29 30 1 1 33 5 1 0 29 8 1 0 29 11 1 0 26 13 1 0 24 16 1 0 1 34 1 0 1 35 1 0 1 36 1 0 3 37 1 0 3 38 1 0 3 39 1 0 4 40 1 0 5 41 1 6 6 42 1 0 6 43 1 0 7 44 1 6 31 80 1 1 32 81 1 0 8 45 1 1 9 46 1 0 9 47 1 0 10 48 1 0 10 49 1 0 12 50 1 0 12 51 1 0 12 52 1 0 14 53 1 0 15 54 1 0 15 55 1 0 16 56 1 6 18 57 1 0 18 58 1 0 18 59 1 0 19 60 1 0 19 61 1 0 19 62 1 0 20 63 1 1 21 64 1 0 22 65 1 0 22 66 1 0 23 67 1 0 23 68 1 0 25 69 1 0 25 70 1 0 25 71 1 0 26 72 1 6 27 73 1 0 27 74 1 0 28 75 1 0 28 76 1 0 30 77 1 0 30 78 1 0 30 79 1 0 M END