RDKit 3D 106110 0 0 0 0 0 0 0 0999 V2000 7.4927 0.6225 0.8787 C 0 0 0 0 0 0 0 0 0 0 0 0 6.8866 0.3576 -0.2685 C 0 0 0 0 0 0 0 0 0 0 0 0 5.9200 -0.7286 -0.3956 C 0 0 0 0 0 0 0 0 0 0 0 0 4.4985 -0.3925 -0.7042 C 0 0 0 0 0 0 0 0 0 0 0 0 3.8138 0.3520 0.3375 C 0 0 1 0 0 0 0 0 0 0 0 0 4.4218 1.6532 0.6437 C 0 0 0 0 0 0 0 0 0 0 0 0 4.7939 1.8657 1.8503 O 0 0 0 0 0 0 0 0 0 0 0 0 4.6420 2.6933 -0.2170 O 0 0 0 0 0 0 0 0 0 0 0 0 2.3601 0.5811 0.2142 C 0 0 1 0 0 0 0 0 0 0 0 0 1.8576 1.3341 -0.9682 C 0 0 0 0 0 0 0 0 0 0 0 0 0.3312 1.1097 -0.8592 C 0 0 0 0 0 0 0 0 0 0 0 0 0.1210 0.2661 0.3613 C 0 0 1 0 0 0 0 0 0 0 0 0 0.0745 1.0530 1.6387 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.0513 -0.6288 0.3507 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.8567 -1.8133 0.9413 C 0 0 0 0 0 0 0 0 0 0 0 0 0.2396 -1.9841 1.9169 C 0 0 0 0 0 0 0 0 0 0 0 0 1.5600 -1.4563 1.4389 C 0 0 0 0 0 0 0 0 0 0 0 0 1.4188 -0.5681 0.2681 C 0 0 2 0 0 0 0 0 0 0 0 0 1.3006 -1.3238 -1.0354 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.7755 -2.9271 0.6111 C 0 0 1 0 0 0 0 0 0 0 0 0 -1.5343 -3.3705 -0.8197 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.5863 -4.0856 1.5623 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.5998 -5.1564 1.2720 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.0072 -4.7296 1.2098 C 0 0 2 0 0 0 0 0 0 0 0 0 -4.7095 -5.6175 0.3546 O 0 0 0 0 0 0 0 0 0 0 0 0 -4.2763 -3.3136 0.9034 C 0 0 1 0 0 0 0 0 0 0 0 0 -5.1248 -3.3060 -0.3875 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.2811 -2.7820 1.9531 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.1458 -2.3726 0.8116 C 0 0 2 0 0 0 0 0 0 0 0 0 -3.3891 -1.3150 -0.2430 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.3583 -0.2224 -0.2565 C 0 0 1 0 0 0 0 0 0 0 0 0 -2.8742 0.8004 0.5222 O 0 0 0 0 0 0 0 0 0 0 0 0 -3.0625 2.0134 -0.0882 C 0 0 2 0 0 0 0 0 0 0 0 0 -2.3114 2.9575 0.5757 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.3983 4.2209 0.0456 C 0 0 2 0 0 0 0 0 0 0 0 0 -2.9264 5.1975 1.0815 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.9797 6.4536 0.4569 O 0 0 0 0 0 0 0 0 0 0 0 0 -3.1858 4.2614 -1.2181 C 0 0 2 0 0 0 0 0 0 0 0 0 -3.2622 5.5987 -1.6664 O 0 0 0 0 0 0 0 0 0 0 0 0 -4.5618 3.6908 -1.0182 C 0 0 1 0 0 0 0 0 0 0 0 0 -5.0960 3.3596 -2.2648 O 0 0 0 0 0 0 0 0 0 0 0 0 -4.4862 2.4926 -0.1059 C 0 0 1 0 0 0 0 0 0 0 0 0 -5.3858 1.5612 -0.6257 O 0 0 0 0 0 0 0 0 0 0 0 0 7.2767 1.1877 -1.4541 C 0 0 1 0 0 0 0 0 0 0 0 0 8.3092 2.2194 -1.1191 C 0 0 0 0 0 0 0 0 0 0 0 0 7.8645 0.2895 -2.5458 C 0 0 0 0 0 0 0 0 0 0 0 0 8.2112 1.4124 1.0182 H 0 0 0 0 0 0 0 0 0 0 0 0 7.2818 0.0224 1.7798 H 0 0 0 0 0 0 0 0 0 0 0 0 6.3561 -1.4172 -1.2013 H 0 0 0 0 0 0 0 0 0 0 0 0 5.9784 -1.4284 0.5105 H 0 0 0 0 0 0 0 0 0 0 0 0 4.0255 -1.3741 -0.9761 H 0 0 0 0 0 0 0 0 0 0 0 0 4.5115 0.1609 -1.6971 H 0 0 0 0 0 0 0 0 0 0 0 0 3.9234 -0.2761 1.2961 H 0 0 0 0 0 0 0 0 0 0 0 0 4.1423 3.5629 -0.2460 H 0 0 0 0 0 0 0 0 0 0 0 0 2.0971 1.2394 1.1028 H 0 0 0 0 0 0 0 0 0 0 0 0 2.1218 2.4053 -0.8255 H 0 0 0 0 0 0 0 0 0 0 0 0 2.2470 1.0536 -1.9412 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0625 2.1305 -0.6383 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0765 0.6966 -1.7883 H 0 0 0 0 0 0 0 0 0 0 0 0 0.6953 0.6880 2.4489 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9781 1.0672 2.0533 H 0 0 0 0 0 0 0 0 0 0 0 0 0.2944 2.1226 1.4433 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0378 -1.5325 2.9153 H 0 0 0 0 0 0 0 0 0 0 0 0 0.3667 -3.0573 2.1394 H 0 0 0 0 0 0 0 0 0 0 0 0 2.0780 -0.9249 2.2908 H 0 0 0 0 0 0 0 0 0 0 0 0 2.2668 -2.2997 1.1958 H 0 0 0 0 0 0 0 0 0 0 0 0 1.9255 -0.9168 -1.8561 H 0 0 0 0 0 0 0 0 0 0 0 0 0.2602 -1.2623 -1.4724 H 0 0 0 0 0 0 0 0 0 0 0 0 1.4777 -2.4029 -0.8597 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.2345 -4.1852 -1.1149 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.7002 -2.5700 -1.5600 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5021 -3.7457 -0.9510 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.7440 -3.7249 2.5836 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5952 -4.5623 1.3768 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.2973 -5.6420 0.3060 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.4340 -5.9678 2.0407 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.4571 -4.9746 2.2199 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.0660 -5.7982 -0.3949 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.5499 -3.5996 -1.2663 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.7132 -2.3910 -0.4865 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.8713 -4.1371 -0.2109 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.8031 -2.6807 2.9293 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.1332 -3.4931 1.9568 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.6506 -1.8215 1.5383 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.0972 -1.7778 1.7777 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.5286 -1.8410 -1.2013 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.4090 -0.9086 0.0016 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.1638 0.1239 -1.2687 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.7290 1.9730 -1.1406 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.3295 4.5765 -0.1351 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.1572 5.2685 1.8773 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.9282 4.9532 1.4416 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.8853 6.8297 0.4588 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.7004 3.7202 -2.0626 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.1981 5.8657 -1.8455 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.2631 4.4639 -0.5819 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.4125 3.0187 -2.8676 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.8453 2.8181 0.8897 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.0032 1.0120 -1.3371 H 0 0 0 0 0 0 0 0 0 0 0 0 6.3802 1.6319 -1.8720 H 0 0 0 0 0 0 0 0 0 0 0 0 9.2418 1.7407 -0.7103 H 0 0 0 0 0 0 0 0 0 0 0 0 8.6403 2.6870 -2.0824 H 0 0 0 0 0 0 0 0 0 0 0 0 7.9789 2.9963 -0.4271 H 0 0 0 0 0 0 0 0 0 0 0 0 8.3798 0.9814 -3.2467 H 0 0 0 0 0 0 0 0 0 0 0 0 8.6380 -0.3912 -2.1483 H 0 0 0 0 0 0 0 0 0 0 0 0 7.0805 -0.2174 -3.1176 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 2 3 2 3 1 0 3 4 1 0 4 5 1 0 5 6 1 0 6 7 2 0 6 8 1 0 5 9 1 0 9 10 1 0 10 11 1 0 11 12 1 0 12 13 1 1 12 14 1 0 14 15 2 0 15 16 1 0 16 17 1 0 17 18 1 0 18 19 1 6 15 20 1 0 20 21 1 6 20 22 1 0 22 23 1 0 23 24 1 0 24 25 1 0 24 26 1 0 26 27 1 6 26 28 1 0 26 29 1 0 29 30 1 0 30 31 1 0 31 32 1 0 32 33 1 0 33 34 1 0 34 35 1 0 35 36 1 0 36 37 1 0 35 38 1 0 38 39 1 0 38 40 1 0 40 41 1 0 40 42 1 0 42 43 1 0 2 44 1 0 44 45 1 0 44 46 1 0 18 9 1 0 29 20 1 0 42 33 1 0 18 12 1 0 31 14 1 0 1 47 1 0 1 48 1 0 3 49 1 0 3 50 1 0 4 51 1 0 4 52 1 0 5 53 1 1 8 54 1 0 9 55 1 1 10 56 1 0 10 57 1 0 11 58 1 0 11 59 1 0 13 60 1 0 13 61 1 0 13 62 1 0 16 63 1 0 16 64 1 0 17 65 1 0 17 66 1 0 19 67 1 0 19 68 1 0 19 69 1 0 21 70 1 0 21 71 1 0 21 72 1 0 22 73 1 0 22 74 1 0 23 75 1 0 23 76 1 0 24 77 1 1 25 78 1 0 27 79 1 0 27 80 1 0 27 81 1 0 28 82 1 0 28 83 1 0 28 84 1 0 29 85 1 1 30 86 1 0 30 87 1 0 31 88 1 6 33 89 1 6 35 90 1 6 36 91 1 0 36 92 1 0 37 93 1 0 38 94 1 6 39 95 1 0 40 96 1 1 41 97 1 0 42 98 1 1 43 99 1 0 44100 1 6 45101 1 0 45102 1 0 45103 1 0 46104 1 0 46105 1 0 46106 1 0 M END