RDKit 3D 111110 0 0 0 0 0 0 0 0999 V2000 -17.5620 1.2874 0.5446 C 0 0 0 0 0 0 0 0 0 0 0 0 -17.8481 -0.1211 0.5153 O 0 0 0 0 0 0 0 0 0 0 0 0 -16.8467 -1.0382 0.1654 C 0 0 0 0 0 0 0 0 0 0 0 0 -15.7349 -0.4269 -0.0849 O 0 0 0 0 0 0 0 0 0 0 0 0 -16.9245 -2.4464 0.0695 C 0 0 0 0 0 0 0 0 0 0 0 0 -15.9142 -3.2903 -0.1355 C 0 0 0 0 0 0 0 0 0 0 0 0 -14.5629 -2.8667 -0.2363 C 0 0 0 0 0 0 0 0 0 0 0 0 -14.3459 -2.1451 1.2481 C 0 0 0 0 0 0 0 0 0 0 0 0 -13.3917 -3.2155 -0.5852 C 0 0 0 0 0 0 0 0 0 0 0 0 -12.3550 -1.8027 -0.3047 C 0 0 0 0 0 0 0 0 0 0 0 0 -11.2428 -2.4578 -0.6962 C 0 0 0 0 0 0 0 0 0 0 0 0 -10.0622 -1.5730 -0.6042 C 0 0 0 0 0 0 0 0 0 0 0 0 -10.5405 -0.1225 -0.0697 C 0 0 0 0 0 0 0 0 0 0 0 0 -8.8632 -1.6484 -0.8085 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.6150 -2.1890 -1.1600 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.5077 -1.4021 -1.1848 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.6494 -0.0141 -0.8591 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.5467 0.7614 -0.8582 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.7508 2.2226 -0.4988 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.2601 0.1542 -1.0525 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.1388 -0.2601 -1.2140 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.9567 0.5840 -1.2880 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.7201 0.0796 -1.3763 C 0 0 0 0 0 0 0 0 0 0 0 0 0.3518 1.1479 -1.4300 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.4490 -1.2930 -1.6980 C 0 0 0 0 0 0 0 0 0 0 0 0 0.6345 -1.9462 -1.6183 C 0 0 0 0 0 0 0 0 0 0 0 0 1.9615 -1.6086 -1.1634 C 0 0 0 0 0 0 0 0 0 0 0 0 2.9415 -2.4529 -1.2257 O 0 0 0 0 0 0 0 0 0 0 0 0 2.3209 -0.4217 -0.6084 O 0 0 0 0 0 0 0 0 0 0 0 0 3.5190 0.0028 -0.0609 C 0 0 0 0 0 0 0 0 0 0 0 0 3.3428 1.4073 0.3909 C 0 0 0 0 0 0 0 0 0 0 0 0 3.9960 2.4306 0.0391 C 0 0 0 0 0 0 0 0 0 0 0 0 3.4818 3.7516 0.7786 C 0 0 0 0 0 0 0 0 0 0 0 0 4.9563 2.6944 -0.9886 C 0 0 0 0 0 0 0 0 0 0 0 0 6.4214 2.8315 -0.5337 C 0 0 0 0 0 0 0 0 0 0 0 0 6.6984 3.6721 0.6137 C 0 0 0 0 0 0 0 0 0 0 0 0 7.4775 3.4290 1.6678 C 0 0 0 0 0 0 0 0 0 0 0 0 7.5229 4.5213 2.7222 C 0 0 0 0 0 0 0 0 0 0 0 0 8.4525 2.3721 1.8818 C 0 0 0 0 0 0 0 0 0 0 0 0 8.7735 1.3897 0.8480 C 0 0 0 0 0 0 0 0 0 0 0 0 9.8565 0.4365 1.2963 C 0 0 0 0 0 0 0 0 0 0 0 0 11.0612 0.4200 0.7435 C 0 0 0 0 0 0 0 0 0 0 0 0 11.4194 1.3480 -0.3323 C 0 0 0 0 0 0 0 0 0 0 0 0 11.9844 -0.6843 1.1553 C 0 0 0 0 0 0 0 0 0 0 0 0 12.3803 -1.4732 -0.0940 C 0 0 0 0 0 0 0 0 0 0 0 0 13.0994 -2.6911 0.3159 C 0 0 0 0 0 0 0 0 0 0 0 0 14.3204 -3.0527 0.0323 C 0 0 0 0 0 0 0 0 0 0 0 0 14.7389 -4.3863 0.6154 C 0 0 0 0 0 0 0 0 0 0 0 0 15.3496 -2.3302 -0.7259 C 0 0 0 0 0 0 0 0 0 0 0 0 -16.6122 1.5261 -0.0421 H 0 0 0 0 0 0 0 0 0 0 0 0 -17.5482 1.6299 1.5591 H 0 0 0 0 0 0 0 0 0 0 0 0 -18.3991 1.8001 -0.0205 H 0 0 0 0 0 0 0 0 0 0 0 0 -17.9251 -2.8897 0.1451 H 0 0 0 0 0 0 0 0 0 0 0 0 -16.1366 -4.3642 -0.2205 H 0 0 0 0 0 0 0 0 0 0 0 0 -14.3816 -3.2456 1.8052 H 0 0 0 0 0 0 0 0 0 0 0 0 -15.1970 -1.7224 1.6280 H 0 0 0 0 0 0 0 0 0 0 0 0 -13.3330 -1.9466 1.4284 H 0 0 0 0 0 0 0 0 0 0 0 0 -12.8789 -3.9527 -0.9499 H 0 0 0 0 0 0 0 0 0 0 0 0 -13.1230 -1.4212 -0.0483 H 0 0 0 0 0 0 0 0 0 0 0 0 -11.1008 -3.4013 -1.0480 H 0 0 0 0 0 0 0 0 0 0 0 0 -11.6079 -0.1188 0.0007 H 0 0 0 0 0 0 0 0 0 0 0 0 -10.0837 0.5325 -0.8403 H 0 0 0 0 0 0 0 0 0 0 0 0 -9.9664 -0.0607 0.8442 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.4912 -0.5896 -0.1641 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.5144 -3.2187 -1.3834 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.5999 -1.8506 -1.4585 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.5395 0.4989 -0.6341 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.0716 2.4296 0.4038 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.3470 2.7958 -1.3305 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.7902 2.4016 -0.2430 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.7726 1.4789 -1.2523 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.9611 -1.3757 -1.3228 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.1292 1.6652 -1.2843 H 0 0 0 0 0 0 0 0 0 0 0 0 0.6173 1.5346 -0.4377 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.2347 2.0571 -1.8900 H 0 0 0 0 0 0 0 0 0 0 0 0 1.0934 0.9322 -2.1830 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.3278 -1.8968 -2.1173 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5806 -3.0020 -2.0205 H 0 0 0 0 0 0 0 0 0 0 0 0 3.7610 -0.5480 0.8979 H 0 0 0 0 0 0 0 0 0 0 0 0 4.3512 -0.1090 -0.7121 H 0 0 0 0 0 0 0 0 0 0 0 0 2.4971 1.5220 1.1382 H 0 0 0 0 0 0 0 0 0 0 0 0 4.2146 4.4905 0.7396 H 0 0 0 0 0 0 0 0 0 0 0 0 2.6662 4.0785 0.0283 H 0 0 0 0 0 0 0 0 0 0 0 0 3.0865 3.4878 1.7620 H 0 0 0 0 0 0 0 0 0 0 0 0 4.7567 3.7197 -1.4573 H 0 0 0 0 0 0 0 0 0 0 0 0 4.9878 2.0207 -1.8398 H 0 0 0 0 0 0 0 0 0 0 0 0 6.9255 3.3212 -1.4493 H 0 0 0 0 0 0 0 0 0 0 0 0 6.8285 1.8031 -0.5254 H 0 0 0 0 0 0 0 0 0 0 0 0 6.2465 4.6820 0.5835 H 0 0 0 0 0 0 0 0 0 0 0 0 6.5205 4.6414 3.2274 H 0 0 0 0 0 0 0 0 0 0 0 0 7.7930 5.4536 2.2765 H 0 0 0 0 0 0 0 0 0 0 0 0 8.1862 4.1660 3.5567 H 0 0 0 0 0 0 0 0 0 0 0 0 9.4312 2.8966 2.2025 H 0 0 0 0 0 0 0 0 0 0 0 0 8.2435 1.7978 2.8272 H 0 0 0 0 0 0 0 0 0 0 0 0 7.8823 0.6669 0.7859 H 0 0 0 0 0 0 0 0 0 0 0 0 8.9937 1.7607 -0.1495 H 0 0 0 0 0 0 0 0 0 0 0 0 9.6119 -0.2180 2.1090 H 0 0 0 0 0 0 0 0 0 0 0 0 12.5386 1.3706 -0.5097 H 0 0 0 0 0 0 0 0 0 0 0 0 10.8574 1.1087 -1.2854 H 0 0 0 0 0 0 0 0 0 0 0 0 11.1507 2.3898 -0.1143 H 0 0 0 0 0 0 0 0 0 0 0 0 12.8250 -0.2282 1.6597 H 0 0 0 0 0 0 0 0 0 0 0 0 11.4675 -1.3808 1.8273 H 0 0 0 0 0 0 0 0 0 0 0 0 13.0906 -0.8643 -0.7320 H 0 0 0 0 0 0 0 0 0 0 0 0 11.4990 -1.7110 -0.6903 H 0 0 0 0 0 0 0 0 0 0 0 0 12.5508 -3.4302 0.9869 H 0 0 0 0 0 0 0 0 0 0 0 0 13.9550 -5.1532 0.3616 H 0 0 0 0 0 0 0 0 0 0 0 0 15.6604 -4.7825 0.1543 H 0 0 0 0 0 0 0 0 0 0 0 0 14.8704 -4.2929 1.6961 H 0 0 0 0 0 0 0 0 0 0 0 0 15.4098 -2.6550 -1.7826 H 0 0 0 0 0 0 0 0 0 0 0 0 15.2727 -1.2239 -0.5961 H 0 0 0 0 0 0 0 0 0 0 0 0 16.3760 -2.5907 -0.2591 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 3 5 1 0 5 6 2 0 6 7 1 0 7 8 1 0 7 9 2 0 9 10 1 0 10 11 2 0 11 12 1 0 12 13 1 0 12 14 2 0 14 15 1 0 15 16 2 0 16 17 1 0 17 18 2 0 18 19 1 0 18 20 1 0 20 21 2 0 21 22 1 0 22 23 2 0 23 24 1 0 23 25 1 0 25 26 2 0 26 27 1 0 27 28 2 0 27 29 1 0 29 30 1 0 30 31 1 0 31 32 2 0 32 33 1 0 32 34 1 0 34 35 1 0 35 36 1 0 36 37 2 0 37 38 1 0 37 39 1 0 39 40 1 0 40 41 1 0 41 42 2 0 42 43 1 0 42 44 1 0 44 45 1 0 45 46 1 0 46 47 2 3 47 48 1 0 47 49 1 0 1 50 1 0 1 51 1 0 1 52 1 0 5 53 1 0 6 54 1 0 8 55 1 0 8 56 1 0 8 57 1 0 9 58 1 0 10 59 1 0 11 60 1 0 13 61 1 0 13 62 1 0 13 63 1 0 14 64 1 0 15 65 1 0 16 66 1 0 17 67 1 0 19 68 1 0 19 69 1 0 19 70 1 0 20 71 1 0 21 72 1 0 22 73 1 0 24 74 1 0 24 75 1 0 24 76 1 0 25 77 1 0 26 78 1 0 30 79 1 0 30 80 1 0 31 81 1 0 33 82 1 0 33 83 1 0 33 84 1 0 34 85 1 0 34 86 1 0 35 87 1 0 35 88 1 0 36 89 1 0 38 90 1 0 38 91 1 0 38 92 1 0 39 93 1 0 39 94 1 0 40 95 1 0 40 96 1 0 41 97 1 0 43 98 1 0 43 99 1 0 43100 1 0 44101 1 0 44102 1 0 45103 1 0 45104 1 0 46105 1 0 48106 1 0 48107 1 0 48108 1 0 49109 1 0 49110 1 0 49111 1 0 M END