RDKit 3D 97100 0 0 0 0 0 0 0 0999 V2000 -5.3360 3.2463 0.7337 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.5732 2.6505 -0.4845 O 0 0 0 0 0 0 0 0 0 0 0 0 -6.4895 1.5706 -0.3859 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.6151 2.0239 -1.0934 O 0 0 0 0 0 0 0 0 0 0 0 0 -8.6982 2.2266 -0.2739 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.8833 0.3349 -1.0076 C 0 0 2 0 0 0 0 0 0 0 0 0 -6.9021 -0.7804 -0.8805 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.7675 -1.6481 0.3051 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.6428 -1.3811 1.2245 C 0 0 2 0 0 0 0 0 0 0 0 0 -6.0771 -1.3852 2.6971 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.9057 -0.1816 3.0466 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.8500 -1.3793 3.5963 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.8003 -2.5385 2.9731 O 0 0 0 0 0 0 0 0 0 0 0 0 -4.9473 -0.2353 1.0272 O 0 0 0 0 0 0 0 0 0 0 0 0 -4.6062 0.0448 -0.3046 C 0 0 1 0 0 0 0 0 0 0 0 0 -3.7605 -1.0126 -0.8500 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.2029 -0.9552 -2.2015 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.2758 0.1948 -2.4211 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.6594 1.6186 -2.4059 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.9699 -0.0738 -2.7193 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0118 0.9966 -2.9409 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0894 0.9887 -1.9037 C 0 0 0 0 0 0 0 0 0 0 0 0 1.9014 -0.2078 -1.8519 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2999 -1.5150 -1.4049 C 0 0 0 0 0 0 0 0 0 0 0 0 3.1822 -0.2378 -2.1159 C 0 0 0 0 0 0 0 0 0 0 0 0 3.9599 0.9481 -2.4993 C 0 0 0 0 0 0 0 0 0 0 0 0 5.1168 1.0932 -1.5285 C 0 0 1 0 0 0 0 0 0 0 0 0 5.8894 2.2029 -1.8444 O 0 0 0 0 0 0 0 0 0 0 0 0 4.6380 1.1117 -0.1264 C 0 0 0 0 0 0 0 0 0 0 0 0 3.4751 1.4319 0.2173 O 0 0 0 0 0 0 0 0 0 0 0 0 5.5869 0.7291 0.9446 C 0 0 0 0 0 0 0 0 0 0 0 0 5.3714 1.1653 2.2194 C 0 0 0 0 0 0 0 0 0 0 0 0 4.2547 1.9617 2.4756 O 0 0 0 0 0 0 0 0 0 0 0 0 6.2486 0.8174 3.2230 C 0 0 0 0 0 0 0 0 0 0 0 0 7.3771 0.0207 3.0010 C 0 0 0 0 0 0 0 0 0 0 0 0 8.2925 -0.3252 4.1219 C 0 0 0 0 0 0 0 0 0 0 0 0 7.5829 -0.4131 1.7091 C 0 0 0 0 0 0 0 0 0 0 0 0 8.6948 -1.2138 1.4111 C 0 0 0 0 0 0 0 0 0 0 0 0 9.5380 -1.5303 2.4580 O 0 0 0 0 0 0 0 0 0 0 0 0 8.9232 -1.6572 0.1312 C 0 0 0 0 0 0 0 0 0 0 0 0 10.0877 -2.4964 -0.2271 C 0 0 0 0 0 0 0 0 0 0 0 0 8.0226 -1.2874 -0.8427 C 0 0 0 0 0 0 0 0 0 0 0 0 8.1721 -1.6906 -2.1630 O 0 0 0 0 0 0 0 0 0 0 0 0 6.9109 -0.4966 -0.5891 C 0 0 0 0 0 0 0 0 0 0 0 0 6.6916 -0.0603 0.6858 C 0 0 0 0 0 0 0 0 0 0 0 0 5.9868 -0.1294 -1.6572 C 0 0 0 0 0 0 0 0 0 0 0 0 5.9520 -0.8702 -2.6737 O 0 0 0 0 0 0 0 0 0 0 0 0 -6.2525 3.6665 1.1993 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.8548 2.5113 1.4045 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.6390 4.0751 0.5650 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.7796 1.4637 0.6686 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.9655 1.2970 0.2285 H 0 0 0 0 0 0 0 0 0 0 0 0 -9.5459 2.5425 -0.9168 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.5176 3.0404 0.4614 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.7592 0.6058 -2.1005 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.7134 -1.4180 -1.8023 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.9422 -0.4264 -1.0391 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.7238 -1.5487 0.9037 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.8037 -2.7399 0.0038 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.9323 -2.2588 1.1675 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.6930 -0.0633 2.2926 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.2146 0.7066 3.0631 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.2931 -0.3495 4.0700 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.9776 -0.9082 3.1095 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.5420 -2.4086 3.8833 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.1005 -0.8517 4.5480 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.7290 -2.3422 3.2578 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.0151 0.9895 -0.2297 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.8660 -1.1022 -0.1430 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.2136 -2.0561 -0.7216 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.9566 -1.0184 -3.0247 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.5809 -1.8849 -2.3771 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.7579 1.7642 -2.3505 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.2005 2.2018 -1.5883 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.3363 2.0683 -3.4064 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.6674 -1.1127 -2.8189 H 0 0 0 0 0 0 0 0 0 0 0 0 0.4400 0.8501 -3.9738 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.4697 2.0339 -2.9789 H 0 0 0 0 0 0 0 0 0 0 0 0 0.6045 1.0777 -0.8722 H 0 0 0 0 0 0 0 0 0 0 0 0 1.6265 1.9444 -2.0097 H 0 0 0 0 0 0 0 0 0 0 0 0 2.0499 -1.9644 -0.6712 H 0 0 0 0 0 0 0 0 0 0 0 0 1.2799 -2.1902 -2.2475 H 0 0 0 0 0 0 0 0 0 0 0 0 0.3946 -1.3896 -0.8076 H 0 0 0 0 0 0 0 0 0 0 0 0 3.6868 -1.2225 -2.0403 H 0 0 0 0 0 0 0 0 0 0 0 0 4.4140 0.8360 -3.5237 H 0 0 0 0 0 0 0 0 0 0 0 0 3.4113 1.8726 -2.5165 H 0 0 0 0 0 0 0 0 0 0 0 0 6.8358 2.1042 -1.6098 H 0 0 0 0 0 0 0 0 0 0 0 0 4.0470 2.3141 3.4056 H 0 0 0 0 0 0 0 0 0 0 0 0 6.0707 1.1718 4.2443 H 0 0 0 0 0 0 0 0 0 0 0 0 8.2790 -1.4057 4.3839 H 0 0 0 0 0 0 0 0 0 0 0 0 9.2907 0.1230 4.0428 H 0 0 0 0 0 0 0 0 0 0 0 0 7.8503 0.1621 5.0465 H 0 0 0 0 0 0 0 0 0 0 0 0 10.3579 -2.0969 2.3642 H 0 0 0 0 0 0 0 0 0 0 0 0 10.9139 -2.4728 0.5067 H 0 0 0 0 0 0 0 0 0 0 0 0 9.7372 -3.5196 -0.4823 H 0 0 0 0 0 0 0 0 0 0 0 0 10.5254 -2.0750 -1.1820 H 0 0 0 0 0 0 0 0 0 0 0 0 8.9565 -2.2721 -2.3967 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 2 3 1 0 3 4 1 0 4 5 1 0 3 6 1 0 6 7 1 0 7 8 1 0 8 9 1 0 9 14 1 0 14 15 1 0 15 16 1 0 16 17 1 0 17 18 1 0 18 19 1 0 18 20 2 0 20 21 1 0 21 22 1 0 22 23 1 0 23 24 1 0 23 25 2 0 25 26 1 0 26 27 1 0 27 28 1 6 27 29 1 0 29 30 2 0 29 31 1 0 31 45 2 0 45 37 1 0 37 35 2 0 35 36 1 0 35 34 1 0 34 32 2 0 32 33 1 0 37 38 1 0 38 39 1 0 38 40 2 0 40 41 1 0 40 42 1 0 42 43 1 0 42 44 2 0 44 46 1 0 46 47 2 0 9 10 1 0 10 11 1 0 10 12 1 0 10 13 1 0 15 6 1 0 46 27 1 0 32 31 1 0 44 45 1 0 1 48 1 0 1 49 1 0 1 50 1 0 3 51 1 0 5 52 1 0 5 53 1 0 5 54 1 0 6 55 1 6 7 56 1 0 7 57 1 0 8 58 1 0 8 59 1 0 9 60 1 1 15 68 1 1 16 69 1 0 16 70 1 0 17 71 1 0 17 72 1 0 19 73 1 0 19 74 1 0 19 75 1 0 20 76 1 0 21 77 1 0 21 78 1 0 22 79 1 0 22 80 1 0 24 81 1 0 24 82 1 0 24 83 1 0 25 84 1 0 26 85 1 0 26 86 1 0 28 87 1 0 36 90 1 0 36 91 1 0 36 92 1 0 34 89 1 0 33 88 1 0 39 93 1 0 41 94 1 0 41 95 1 0 41 96 1 0 43 97 1 0 11 61 1 0 11 62 1 0 11 63 1 0 12 64 1 0 12 65 1 0 12 66 1 0 13 67 1 0 M END