RDKit 3D 98105 0 0 0 0 0 0 0 0999 V2000 3.4917 4.0027 1.4081 O 0 0 0 0 0 0 0 0 0 0 0 0 4.1670 3.0319 0.9900 C 0 0 0 0 0 0 0 0 0 0 0 0 3.5306 1.8376 0.7940 O 0 0 0 0 0 0 0 0 0 0 0 0 2.1746 1.6213 1.0391 C 0 0 2 0 0 0 0 0 0 0 0 0 2.0717 0.6890 2.2195 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1464 -0.4449 2.0437 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2050 -1.5710 2.8580 C 0 0 0 0 0 0 0 0 0 0 0 0 2.1388 -1.6216 3.8739 O 0 0 0 0 0 0 0 0 0 0 0 0 0.3236 -2.6371 2.6448 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.6108 -2.6293 1.6597 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.4985 -3.6639 1.4114 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.6757 -1.5142 0.8501 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.6806 -1.4168 -0.2566 C 0 0 1 0 0 0 0 0 0 0 0 0 -1.9383 -2.6696 -0.9597 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.8882 -3.4870 -1.3339 C 0 0 0 0 0 0 0 0 0 0 0 0 0.4479 -3.2339 -1.1577 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.1430 -4.7167 -1.9741 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.4273 -5.1254 -2.2403 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.6263 -6.3625 -2.8797 O 0 0 0 0 0 0 0 0 0 0 0 0 -3.4689 -4.3061 -1.8689 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.2460 -3.0933 -1.2379 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.3004 -2.2811 -0.8769 O 0 0 0 0 0 0 0 0 0 0 0 0 -4.1634 -1.4103 0.2296 C 0 0 1 0 0 0 0 0 0 0 0 0 -4.5735 -2.2075 1.4132 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.9697 -2.1063 2.6306 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.4244 -2.9359 3.6591 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.4385 -3.8289 3.4814 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.9202 -4.6770 4.4885 O 0 0 0 0 0 0 0 0 0 0 0 0 -6.0641 -3.9382 2.2373 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.1130 -4.8642 2.0649 O 0 0 0 0 0 0 0 0 0 0 0 0 -5.6222 -3.1374 1.2522 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.8890 -0.6962 0.2817 C 0 0 2 0 0 0 0 0 0 0 0 0 -3.0729 0.5507 -0.4372 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.9293 1.7422 0.1949 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.6315 1.8031 1.4029 O 0 0 0 0 0 0 0 0 0 0 0 0 -3.1219 2.9805 -0.5428 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.5086 2.9337 -1.8918 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.6765 4.1039 -2.5924 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.0658 3.9862 -3.9374 O 0 0 0 0 0 0 0 0 0 0 0 0 -3.4646 5.2930 -1.9643 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.6352 6.4613 -2.6716 O 0 0 0 0 0 0 0 0 0 0 0 0 -3.0813 5.3629 -0.6279 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.8748 6.5910 -0.0196 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.9109 4.1883 0.0810 C 0 0 0 0 0 0 0 0 0 0 0 0 0.2100 -0.4395 1.0602 C 0 0 0 0 0 0 0 0 0 0 0 0 0.1168 0.6685 0.2204 O 0 0 0 0 0 0 0 0 0 0 0 0 1.4190 1.2165 -0.1425 C 0 0 2 0 0 0 0 0 0 0 0 0 2.0553 0.3898 -1.1444 C 0 0 0 0 0 0 0 0 0 0 0 0 3.2942 -0.1396 -1.0485 C 0 0 0 0 0 0 0 0 0 0 0 0 3.8332 -0.9234 -2.0742 C 0 0 0 0 0 0 0 0 0 0 0 0 3.0849 -1.1730 -3.2278 C 0 0 0 0 0 0 0 0 0 0 0 0 3.6758 -1.9542 -4.1989 O 0 0 0 0 0 0 0 0 0 0 0 0 1.8219 -0.6457 -3.3483 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0841 -0.9025 -4.5051 O 0 0 0 0 0 0 0 0 0 0 0 0 1.3251 0.1189 -2.3236 C 0 0 0 0 0 0 0 0 0 0 0 0 5.6088 3.1961 0.7241 C 0 0 0 0 0 0 0 0 0 0 0 0 6.1627 4.4303 0.9392 C 0 0 0 0 0 0 0 0 0 0 0 0 7.5019 4.6350 0.7116 C 0 0 0 0 0 0 0 0 0 0 0 0 8.0220 5.9048 0.9447 O 0 0 0 0 0 0 0 0 0 0 0 0 8.2843 3.6012 0.2678 C 0 0 0 0 0 0 0 0 0 0 0 0 9.6307 3.7965 0.0378 O 0 0 0 0 0 0 0 0 0 0 0 0 7.7577 2.3474 0.0411 C 0 0 0 0 0 0 0 0 0 0 0 0 8.5764 1.3475 -0.4010 O 0 0 0 0 0 0 0 0 0 0 0 0 6.4005 2.1720 0.2810 C 0 0 0 0 0 0 0 0 0 0 0 0 1.7080 2.6008 1.4367 H 0 0 0 0 0 0 0 0 0 0 0 0 1.8096 1.2074 3.1630 H 0 0 0 0 0 0 0 0 0 0 0 0 3.0845 0.2258 2.4258 H 0 0 0 0 0 0 0 0 0 0 0 0 2.7688 -0.8708 4.0478 H 0 0 0 0 0 0 0 0 0 0 0 0 0.4022 -3.4872 3.2932 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.4725 -4.4981 1.9867 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.2157 -0.7310 -1.0293 H 0 0 0 0 0 0 0 0 0 0 0 0 0.8318 -2.4188 -0.7797 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.3432 -5.3743 -2.2740 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.6447 -6.3098 -3.9039 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.4870 -4.6075 -2.0694 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.0160 -0.6743 0.0931 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.1644 -1.4200 2.8342 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.9466 -2.8593 4.6255 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.4747 -4.6210 5.4175 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.5749 -4.9627 1.1898 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.0713 -3.1851 0.2761 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.6724 -0.3696 1.3115 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.6559 1.9479 -2.3096 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.2109 3.1001 -4.3625 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.9099 6.4495 -3.6310 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.5970 6.6403 0.9492 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.6163 4.2371 1.1125 H 0 0 0 0 0 0 0 0 0 0 0 0 1.1029 2.1684 -0.6868 H 0 0 0 0 0 0 0 0 0 0 0 0 3.9036 0.0033 -0.1894 H 0 0 0 0 0 0 0 0 0 0 0 0 4.8261 -1.3250 -1.9585 H 0 0 0 0 0 0 0 0 0 0 0 0 4.5961 -2.3344 -4.1034 H 0 0 0 0 0 0 0 0 0 0 0 0 1.4933 -1.4745 -5.2368 H 0 0 0 0 0 0 0 0 0 0 0 0 0.3229 0.5287 -2.4369 H 0 0 0 0 0 0 0 0 0 0 0 0 5.5422 5.2326 1.2866 H 0 0 0 0 0 0 0 0 0 0 0 0 7.4490 6.6576 1.2643 H 0 0 0 0 0 0 0 0 0 0 0 0 10.1174 4.6566 0.1703 H 0 0 0 0 0 0 0 0 0 0 0 0 8.2189 0.4221 -0.5711 H 0 0 0 0 0 0 0 0 0 0 0 0 5.9887 1.1960 0.1063 H 0 0 0 0 0 0 0 0 0 0 0 0 19 18 1 0 18 17 2 0 17 15 1 0 15 16 1 0 15 14 2 0 14 13 1 0 13 32 1 0 32 33 1 0 33 34 1 0 34 35 2 0 34 36 1 0 36 37 2 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 32 23 1 0 23 22 1 0 22 21 1 0 21 20 2 0 23 24 1 0 24 25 2 0 25 26 1 0 26 27 2 0 27 28 1 0 27 29 1 0 29 30 1 0 29 31 2 0 13 12 1 0 12 45 2 0 45 46 1 0 46 47 1 0 47 4 1 0 4 5 1 0 5 6 1 0 6 7 2 0 7 8 1 0 7 9 1 0 9 10 2 0 10 11 1 0 4 3 1 0 3 2 1 0 2 1 2 0 2 56 1 0 56 57 2 0 57 58 1 0 58 59 1 0 58 60 2 0 60 61 1 0 60 62 1 0 62 63 1 0 62 64 2 0 47 48 1 0 48 49 2 0 49 50 1 0 50 51 2 0 51 52 1 0 51 53 1 0 53 54 1 0 53 55 2 0 20 18 1 0 31 24 1 0 10 12 1 0 64 56 1 0 55 48 1 0 21 14 1 0 6 45 1 0 44 36 1 0 19 74 1 0 17 73 1 0 16 72 1 0 13 71 1 6 32 82 1 1 37 83 1 0 39 84 1 0 41 85 1 0 43 86 1 0 44 87 1 0 23 76 1 6 20 75 1 0 25 77 1 0 26 78 1 0 28 79 1 0 30 80 1 0 31 81 1 0 47 88 1 6 4 65 1 1 5 66 1 0 5 67 1 0 8 68 1 0 9 69 1 0 11 70 1 0 57 94 1 0 59 95 1 0 61 96 1 0 63 97 1 0 64 98 1 0 49 89 1 0 50 90 1 0 52 91 1 0 54 92 1 0 55 93 1 0 M END