RDKit 3D 122125 0 0 0 0 0 0 0 0999 V2000 12.3791 -1.6097 0.4827 C 0 0 0 0 0 0 0 0 0 0 0 0 11.5738 -0.5895 1.2166 C 0 0 0 0 0 0 0 0 0 0 0 0 12.0523 -0.0631 2.2554 O 0 0 0 0 0 0 0 0 0 0 0 0 10.3116 -0.1798 0.8181 O 0 0 0 0 0 0 0 0 0 0 0 0 9.5455 0.7919 1.5172 C 0 0 2 0 0 0 0 0 0 0 0 0 8.3306 0.1390 2.0697 C 0 0 0 0 0 0 0 0 0 0 0 0 7.1257 1.0175 2.0143 C 0 0 0 0 0 0 0 0 0 0 0 0 6.8730 1.3599 0.5367 C 0 0 1 0 0 0 0 0 0 0 0 0 5.6523 2.2977 0.5918 C 0 0 0 0 0 0 0 0 0 0 0 0 8.0298 2.0419 -0.0856 C 0 0 2 0 0 0 0 0 0 0 0 0 8.2494 1.6016 -1.5433 C 0 0 0 0 0 0 0 0 0 0 0 0 8.3182 0.1343 -1.6361 C 0 0 0 0 0 0 0 0 0 0 0 0 7.4515 -0.5756 -0.9503 C 0 0 0 0 0 0 0 0 0 0 0 0 7.5545 -2.0549 -1.0503 C 0 0 0 0 0 0 0 0 0 0 0 0 6.4265 0.0786 -0.1043 C 0 0 2 0 0 0 0 0 0 0 0 0 5.1783 0.2476 -0.9393 C 0 0 0 0 0 0 0 0 0 0 0 0 4.7530 -1.0622 -1.5594 C 0 0 0 0 0 0 0 0 0 0 0 0 3.5156 -0.8124 -2.3939 C 0 0 0 0 0 0 0 0 0 0 0 0 3.6380 0.1244 -3.5365 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3813 -1.4214 -2.1299 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1764 -1.1825 -2.9353 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0745 -0.6749 -2.2234 O 0 0 0 0 0 0 0 0 0 0 0 0 0.0490 0.5003 -1.5173 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0729 1.2133 -1.4710 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.1624 0.9798 -0.7881 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.2737 0.0187 -0.8962 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.1338 -1.0604 -1.4925 O 0 0 0 0 0 0 0 0 0 0 0 0 -3.4958 0.3112 -0.3306 O 0 0 0 0 0 0 0 0 0 0 0 0 -4.5471 -0.5901 -0.4256 C 0 0 2 0 0 0 0 0 0 0 0 0 -5.7122 -0.0715 -1.2480 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.5628 -1.3169 -1.4775 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.1995 -1.7973 -0.2085 C 0 0 1 0 0 0 0 0 0 0 0 0 -7.6493 -3.2213 -0.4946 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.2745 -1.8262 0.9562 C 0 0 2 0 0 0 0 0 0 0 0 0 -7.0283 -1.4303 2.2371 C 0 0 0 0 0 0 0 0 0 0 0 0 -8.3582 -2.1059 2.2785 C 0 0 0 0 0 0 0 0 0 0 0 0 -9.1232 -1.9021 1.1813 C 0 0 0 0 0 0 0 0 0 0 0 0 -10.4267 -2.5467 1.1361 C 0 0 0 0 0 0 0 0 0 0 0 0 -8.4786 -1.0394 0.1514 C 0 0 2 0 0 0 0 0 0 0 0 0 -9.3206 -0.7593 -1.0406 C 0 0 0 0 0 0 0 0 0 0 0 0 -10.5532 0.0098 -0.6635 C 0 0 0 0 0 0 0 0 0 0 0 0 -10.1857 1.3464 -0.0455 C 0 0 0 0 0 0 0 0 0 0 0 0 -9.4204 2.2904 -0.8734 C 0 0 0 0 0 0 0 0 0 0 0 0 -10.5608 1.6259 1.1867 C 0 0 0 0 0 0 0 0 0 0 0 0 -10.2838 2.8598 1.9095 C 0 0 0 0 0 0 0 0 0 0 0 0 -9.5580 3.7375 1.1336 O 0 0 0 0 0 0 0 0 0 0 0 0 -5.0535 -1.0016 0.9092 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.1474 0.2651 1.7554 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.8988 -1.7810 1.5700 C 0 0 0 0 0 0 0 0 0 0 0 0 9.3024 2.0263 0.7061 C 0 0 0 0 0 0 0 0 0 0 0 0 9.4246 3.2564 1.5818 C 0 0 0 0 0 0 0 0 0 0 0 0 10.4641 2.0954 -0.2806 C 0 0 0 0 0 0 0 0 0 0 0 0 13.4836 -1.3974 0.5880 H 0 0 0 0 0 0 0 0 0 0 0 0 12.2224 -2.6257 0.8719 H 0 0 0 0 0 0 0 0 0 0 0 0 12.1533 -1.4998 -0.5942 H 0 0 0 0 0 0 0 0 0 0 0 0 10.1890 1.1023 2.3907 H 0 0 0 0 0 0 0 0 0 0 0 0 8.4680 -0.1904 3.1258 H 0 0 0 0 0 0 0 0 0 0 0 0 8.0760 -0.8127 1.5168 H 0 0 0 0 0 0 0 0 0 0 0 0 6.2450 0.3720 2.3026 H 0 0 0 0 0 0 0 0 0 0 0 0 7.1164 1.8755 2.6717 H 0 0 0 0 0 0 0 0 0 0 0 0 5.2969 2.5614 -0.4113 H 0 0 0 0 0 0 0 0 0 0 0 0 6.0271 3.2313 1.0649 H 0 0 0 0 0 0 0 0 0 0 0 0 4.8783 1.8898 1.2666 H 0 0 0 0 0 0 0 0 0 0 0 0 7.7668 3.1391 -0.1986 H 0 0 0 0 0 0 0 0 0 0 0 0 9.1323 2.1221 -1.9587 H 0 0 0 0 0 0 0 0 0 0 0 0 7.3876 2.0017 -2.1116 H 0 0 0 0 0 0 0 0 0 0 0 0 9.0937 -0.2985 -2.2766 H 0 0 0 0 0 0 0 0 0 0 0 0 6.7602 -2.6053 -0.5485 H 0 0 0 0 0 0 0 0 0 0 0 0 8.5498 -2.3117 -0.5732 H 0 0 0 0 0 0 0 0 0 0 0 0 7.7131 -2.3334 -2.1232 H 0 0 0 0 0 0 0 0 0 0 0 0 6.1379 -0.7038 0.6639 H 0 0 0 0 0 0 0 0 0 0 0 0 5.2991 0.9746 -1.7612 H 0 0 0 0 0 0 0 0 0 0 0 0 4.3164 0.6026 -0.3406 H 0 0 0 0 0 0 0 0 0 0 0 0 4.5303 -1.8337 -0.7918 H 0 0 0 0 0 0 0 0 0 0 0 0 5.4883 -1.4828 -2.2672 H 0 0 0 0 0 0 0 0 0 0 0 0 4.6917 0.4875 -3.6331 H 0 0 0 0 0 0 0 0 0 0 0 0 3.3396 -0.3510 -4.4995 H 0 0 0 0 0 0 0 0 0 0 0 0 3.0398 1.0263 -3.3214 H 0 0 0 0 0 0 0 0 0 0 0 0 2.3618 -2.1182 -1.2839 H 0 0 0 0 0 0 0 0 0 0 0 0 1.4659 -0.4745 -3.7711 H 0 0 0 0 0 0 0 0 0 0 0 0 0.8512 -2.1498 -3.3997 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.4325 2.0121 -1.0247 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.8628 0.9750 0.3002 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.1936 -1.5078 -0.9790 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.3139 0.6676 -0.7189 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.3805 0.2508 -2.2609 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.2523 -1.2557 -2.3009 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.8226 -2.1233 -1.7653 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.2227 -3.2946 -1.4401 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.1550 -3.6749 0.3622 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.7112 -3.8174 -0.6638 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.9696 -2.8945 1.1764 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.1958 -0.3600 2.3247 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.3861 -1.7339 3.0898 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.6912 -2.7048 3.1020 H 0 0 0 0 0 0 0 0 0 0 0 0 -10.3800 -3.5761 1.6280 H 0 0 0 0 0 0 0 0 0 0 0 0 -11.1373 -2.0035 1.7937 H 0 0 0 0 0 0 0 0 0 0 0 0 -10.8249 -2.7806 0.1278 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.2701 -0.0632 0.6352 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.7224 -0.0431 -1.6793 H 0 0 0 0 0 0 0 0 0 0 0 0 -9.5999 -1.6608 -1.6177 H 0 0 0 0 0 0 0 0 0 0 0 0 -11.0839 0.2309 -1.6346 H 0 0 0 0 0 0 0 0 0 0 0 0 -11.2492 -0.4675 0.0072 H 0 0 0 0 0 0 0 0 0 0 0 0 -9.2578 1.8832 -1.9026 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.4400 2.4645 -0.4139 H 0 0 0 0 0 0 0 0 0 0 0 0 -9.9898 3.2380 -1.0448 H 0 0 0 0 0 0 0 0 0 0 0 0 -11.1448 0.8394 1.7213 H 0 0 0 0 0 0 0 0 0 0 0 0 -9.6671 2.6369 2.8131 H 0 0 0 0 0 0 0 0 0 0 0 0 -11.2095 3.3552 2.3082 H 0 0 0 0 0 0 0 0 0 0 0 0 -9.8282 4.6803 1.2652 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.1270 0.7427 1.6692 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.2610 0.0260 2.8364 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.8650 0.9830 1.3654 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.7884 -1.5314 2.6277 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.9407 -1.5958 1.0781 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.1102 -2.8800 1.4348 H 0 0 0 0 0 0 0 0 0 0 0 0 9.9414 4.0510 1.0050 H 0 0 0 0 0 0 0 0 0 0 0 0 8.4415 3.6906 1.8594 H 0 0 0 0 0 0 0 0 0 0 0 0 10.0539 3.0473 2.4703 H 0 0 0 0 0 0 0 0 0 0 0 0 10.5295 3.0403 -0.8172 H 0 0 0 0 0 0 0 0 0 0 0 0 11.3799 2.0832 0.3873 H 0 0 0 0 0 0 0 0 0 0 0 0 10.5642 1.1788 -0.8829 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 2 3 2 0 2 4 1 0 4 5 1 0 5 6 1 0 6 7 1 0 7 8 1 0 8 9 1 1 8 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 2 0 23 25 1 0 25 26 1 0 26 27 2 0 26 28 1 0 28 29 1 0 29 30 1 0 30 31 1 0 31 32 1 0 32 33 1 6 32 39 1 0 39 40 1 0 40 41 1 0 41 42 1 0 42 43 1 0 42 44 2 0 44 45 1 0 45 46 1 0 39 37 1 0 37 38 1 0 37 36 2 0 36 35 1 0 35 34 1 0 34 47 1 0 47 48 1 0 47 49 1 0 15 13 1 0 13 14 1 0 13 12 2 0 12 11 1 0 11 10 1 0 10 50 1 0 50 51 1 0 50 52 1 0 50 5 1 0 10 8 1 0 47 29 1 0 34 32 1 0 1 53 1 0 1 54 1 0 1 55 1 0 5 56 1 1 6 57 1 0 6 58 1 0 7 59 1 0 7 60 1 0 9 61 1 0 9 62 1 0 9 63 1 0 15 71 1 1 16 72 1 0 16 73 1 0 17 74 1 0 17 75 1 0 19 76 1 0 19 77 1 0 19 78 1 0 20 79 1 0 21 80 1 0 21 81 1 0 25 82 1 0 25 83 1 0 29 84 1 6 30 85 1 0 30 86 1 0 31 87 1 0 31 88 1 0 33 89 1 0 33 90 1 0 33 91 1 0 39 99 1 1 40100 1 0 40101 1 0 41102 1 0 41103 1 0 43104 1 0 43105 1 0 43106 1 0 44107 1 0 45108 1 0 45109 1 0 46110 1 0 38 96 1 0 38 97 1 0 38 98 1 0 36 95 1 0 35 93 1 0 35 94 1 0 34 92 1 1 48111 1 0 48112 1 0 48113 1 0 49114 1 0 49115 1 0 49116 1 0 14 68 1 0 14 69 1 0 14 70 1 0 12 67 1 0 11 65 1 0 11 66 1 0 10 64 1 6 51117 1 0 51118 1 0 51119 1 0 52120 1 0 52121 1 0 52122 1 0 M END