RDKit 3D 142146 0 0 0 0 0 0 0 0999 V2000 -6.1205 3.7313 -3.4020 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.9300 3.2996 -1.9622 C 0 0 1 0 0 0 0 0 0 0 0 0 -7.1676 2.4537 -1.6246 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.7556 2.3423 -1.8912 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.5772 1.9263 -0.4676 C 0 0 1 0 0 0 0 0 0 0 0 0 -3.5043 1.0139 -0.2341 N 0 0 0 0 0 0 0 0 0 0 0 0 -3.1020 -0.0879 -0.9749 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.8746 -0.1274 -1.3443 O 0 0 0 0 0 0 0 0 0 0 0 0 -3.9233 -1.2525 -1.4061 C 0 0 2 0 0 0 0 0 0 0 0 0 -5.1514 -1.4874 -0.6225 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.0441 -1.7219 0.8282 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.4751 -1.9147 1.3563 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.0646 -3.0481 0.6925 N 0 0 0 0 0 0 0 0 0 0 0 0 -8.0104 -3.7538 1.1565 C 0 0 0 0 0 0 0 0 0 0 0 0 -8.4986 -4.8467 0.3956 N 0 0 0 0 0 0 0 0 0 0 0 0 -8.5960 -3.4851 2.4113 N 0 0 0 0 0 0 0 0 0 0 0 0 -3.1513 -2.3685 -1.8480 N 0 0 0 0 0 0 0 0 0 0 0 0 -2.8705 -3.6363 -1.3898 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.5125 -4.6079 -1.9899 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.9770 -4.1757 -0.3436 C 0 0 2 0 0 0 0 0 0 0 0 0 -2.6502 -4.8048 0.8261 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.1530 -4.0007 2.0081 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.4878 -2.7706 1.3983 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.9577 -3.2914 0.1461 N 0 0 0 0 0 0 0 0 0 0 0 0 0.2456 -3.0845 -0.5701 C 0 0 0 0 0 0 0 0 0 0 0 0 0.5727 -1.8829 -0.8348 O 0 0 0 0 0 0 0 0 0 0 0 0 1.1717 -4.1412 -1.0496 C 0 0 2 0 0 0 0 0 0 0 0 0 1.4938 -5.1393 0.0192 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3814 -6.2285 -0.5268 C 0 0 0 0 0 0 0 0 0 0 0 0 2.8905 -7.2350 0.2465 C 0 0 0 0 0 0 0 0 0 0 0 0 3.5998 -8.0484 -0.5555 N 0 0 0 0 0 0 0 0 0 0 0 0 3.5377 -7.5664 -1.7957 C 0 0 0 0 0 0 0 0 0 0 0 0 2.7797 -6.4341 -1.7757 N 0 0 0 0 0 0 0 0 0 0 0 0 2.3212 -3.5819 -1.7035 N 0 0 0 0 0 0 0 0 0 0 0 0 3.5658 -3.1334 -1.2481 C 0 0 0 0 0 0 0 0 0 0 0 0 4.5073 -3.0980 -2.1551 O 0 0 0 0 0 0 0 0 0 0 0 0 4.0430 -2.6837 0.0525 C 0 0 2 0 0 0 0 0 0 0 0 0 4.8603 -3.5868 0.8967 C 0 0 0 0 0 0 0 0 0 0 0 0 6.1686 -4.0720 0.4290 C 0 0 1 0 0 0 0 0 0 0 0 0 6.7355 -4.9488 1.5870 C 0 0 0 0 0 0 0 0 0 0 0 0 6.1637 -4.9738 -0.7663 C 0 0 0 0 0 0 0 0 0 0 0 0 3.0591 -2.0207 0.8939 N 0 0 0 0 0 0 0 0 0 0 0 0 2.9248 -0.6000 0.9045 C 0 0 0 0 0 0 0 0 0 0 0 0 1.8422 -0.1181 1.3739 O 0 0 0 0 0 0 0 0 0 0 0 0 3.9368 0.3426 0.4166 C 0 0 0 0 0 0 0 0 0 0 0 0 4.9984 0.4191 1.3990 N 0 0 0 0 0 0 0 0 0 0 0 0 5.5620 1.6543 1.8025 C 0 0 0 0 0 0 0 0 0 0 0 0 6.0193 1.7928 2.9629 O 0 0 0 0 0 0 0 0 0 0 0 0 5.6289 2.8095 0.8768 C 0 0 2 0 0 0 0 0 0 0 0 0 6.6887 2.4251 -0.1661 C 0 0 0 0 0 0 0 0 0 0 0 0 6.8579 3.5103 -1.1670 C 0 0 0 0 0 0 0 0 0 0 0 0 6.1683 4.5546 -1.0930 O 0 0 0 0 0 0 0 0 0 0 0 0 7.7868 3.3458 -2.1762 O 0 0 0 0 0 0 0 0 0 0 0 0 6.1648 3.9695 1.5588 N 0 0 0 0 0 0 0 0 0 0 0 0 5.6243 5.2750 1.5117 C 0 0 0 0 0 0 0 0 0 0 0 0 6.4493 6.2540 1.4980 O 0 0 0 0 0 0 0 0 0 0 0 0 4.1691 5.5907 1.4762 C 0 0 0 0 0 0 0 0 0 0 0 0 3.9614 7.0243 1.4559 N 0 0 0 0 0 0 0 0 0 0 0 0 3.6260 7.7912 0.3050 C 0 0 0 0 0 0 0 0 0 0 0 0 4.1918 8.9144 0.0962 O 0 0 0 0 0 0 0 0 0 0 0 0 2.6136 7.3248 -0.6947 C 0 0 0 0 0 0 0 0 0 0 0 0 2.7295 7.5445 -2.0489 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2946 6.7936 -2.6433 S 0 0 0 0 0 0 0 0 0 0 0 0 0.6651 6.2665 -1.1554 C 0 0 0 0 0 0 0 0 0 0 0 0 1.5437 6.6701 -0.3004 N 0 0 0 0 0 0 0 0 0 0 0 0 -0.5561 5.5280 -0.6964 C 0 0 1 0 0 0 0 0 0 0 0 0 -0.3980 5.1009 0.7519 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.2607 6.2874 1.5053 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.7193 6.3701 -0.8927 N 0 0 0 0 0 0 0 0 0 0 0 0 -2.8325 6.4741 -0.0417 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.2601 7.6424 0.2592 O 0 0 0 0 0 0 0 0 0 0 0 0 -3.5632 5.3169 0.5441 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.1064 5.3132 1.8170 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.8010 3.7412 1.8903 S 0 0 0 0 0 0 0 0 0 0 0 0 -4.3627 3.1989 0.3209 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.7223 4.2360 -0.1539 N 0 0 0 0 0 0 0 0 0 0 0 0 -5.1527 3.6702 -3.9388 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.8175 3.0425 -3.9453 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.4831 4.7845 -3.3976 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.8862 4.1145 -1.2496 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.0569 2.8061 -2.1844 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.9754 1.3916 -1.8895 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.3793 2.4714 -0.5379 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.0823 1.4663 -2.5296 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.8275 2.7924 -2.2803 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.5362 1.5302 -0.0797 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.9238 1.2097 0.6431 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.3719 -0.8157 -2.4048 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.6522 -2.3888 -1.0679 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.9112 -0.6780 -0.7920 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.6416 -0.8753 1.4144 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.5035 -2.6107 1.1385 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.4841 -1.9939 2.4489 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.0717 -1.0190 1.0482 H 0 0 0 0 0 0 0 0 0 0 0 0 -9.3140 -4.7998 -0.2335 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.0115 -5.7645 0.4678 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.0877 -3.7155 3.2814 H 0 0 0 0 0 0 0 0 0 0 0 0 -9.5370 -3.0577 2.4764 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.6665 -2.1492 -2.8191 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.3700 -5.0454 -0.7937 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.3537 -5.8609 1.0259 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.7531 -4.8092 0.7915 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.4266 -4.5752 2.6168 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.9804 -3.6490 2.6465 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.7521 -2.4248 2.1165 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.1987 -1.9457 1.2306 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5813 -4.7512 -1.8108 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5673 -5.6747 0.3107 H 0 0 0 0 0 0 0 0 0 0 0 0 1.9342 -4.7637 0.9301 H 0 0 0 0 0 0 0 0 0 0 0 0 2.7757 -7.3935 1.2980 H 0 0 0 0 0 0 0 0 0 0 0 0 3.9767 -7.9418 -2.6989 H 0 0 0 0 0 0 0 0 0 0 0 0 2.5609 -5.8492 -2.5896 H 0 0 0 0 0 0 0 0 0 0 0 0 2.1660 -3.4897 -2.7727 H 0 0 0 0 0 0 0 0 0 0 0 0 4.7904 -1.7921 -0.1380 H 0 0 0 0 0 0 0 0 0 0 0 0 5.0302 -3.0581 1.8768 H 0 0 0 0 0 0 0 0 0 0 0 0 4.2645 -4.5101 1.2002 H 0 0 0 0 0 0 0 0 0 0 0 0 6.9429 -3.2876 0.2998 H 0 0 0 0 0 0 0 0 0 0 0 0 6.0283 -5.7720 1.8157 H 0 0 0 0 0 0 0 0 0 0 0 0 6.8601 -4.3493 2.5010 H 0 0 0 0 0 0 0 0 0 0 0 0 7.6873 -5.3985 1.2833 H 0 0 0 0 0 0 0 0 0 0 0 0 6.7932 -5.9099 -0.5648 H 0 0 0 0 0 0 0 0 0 0 0 0 5.1690 -5.3815 -0.9694 H 0 0 0 0 0 0 0 0 0 0 0 0 6.6780 -4.5451 -1.6628 H 0 0 0 0 0 0 0 0 0 0 0 0 2.4102 -2.5356 1.5272 H 0 0 0 0 0 0 0 0 0 0 0 0 4.3263 0.1216 -0.5991 H 0 0 0 0 0 0 0 0 0 0 0 0 3.4630 1.3553 0.3172 H 0 0 0 0 0 0 0 0 0 0 0 0 5.3328 -0.4960 1.8026 H 0 0 0 0 0 0 0 0 0 0 0 0 4.6739 3.0046 0.3679 H 0 0 0 0 0 0 0 0 0 0 0 0 7.6365 2.2886 0.3987 H 0 0 0 0 0 0 0 0 0 0 0 0 6.4329 1.4508 -0.6290 H 0 0 0 0 0 0 0 0 0 0 0 0 8.7184 3.7480 -2.1630 H 0 0 0 0 0 0 0 0 0 0 0 0 7.0235 3.8043 2.1280 H 0 0 0 0 0 0 0 0 0 0 0 0 3.6632 5.2200 2.4149 H 0 0 0 0 0 0 0 0 0 0 0 0 3.6552 5.0636 0.6574 H 0 0 0 0 0 0 0 0 0 0 0 0 4.0762 7.5252 2.3687 H 0 0 0 0 0 0 0 0 0 0 0 0 3.5218 8.0638 -2.6210 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.6665 4.6009 -1.2959 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5566 4.5590 0.9068 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.2790 4.5830 1.1354 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.7145 7.0498 1.0877 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.7274 6.9777 -1.7731 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.1079 6.0924 2.5850 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 2 3 1 0 2 4 1 0 4 5 1 0 5 6 1 0 6 7 1 0 7 8 2 0 7 9 1 0 9 10 1 0 10 11 1 0 11 12 1 0 12 13 1 0 13 14 2 3 14 15 1 0 14 16 1 0 9 17 1 0 17 18 1 0 18 19 2 0 18 20 1 0 20 21 1 0 21 22 1 0 22 23 1 0 23 24 1 0 24 25 1 0 25 26 2 0 25 27 1 0 27 28 1 0 28 29 1 0 29 30 2 0 30 31 1 0 31 32 2 0 32 33 1 0 27 34 1 0 34 35 1 0 35 36 2 0 35 37 1 0 37 38 1 0 38 39 1 0 39 40 1 0 39 41 1 0 37 42 1 0 42 43 1 0 43 44 2 0 43 45 1 0 45 46 1 0 46 47 1 0 47 48 2 0 47 49 1 0 49 50 1 0 50 51 1 0 51 52 2 0 51 53 1 0 49 54 1 0 54 55 1 0 55 56 2 0 55 57 1 0 57 58 1 0 58 59 1 0 59 60 2 0 59 61 1 0 61 62 2 0 62 63 1 0 63 64 1 0 64 65 2 0 64 66 1 0 66 67 1 0 67 68 1 0 66 69 1 0 69 70 1 0 70 71 2 0 70 72 1 0 72 73 2 0 73 74 1 0 74 75 1 0 75 76 2 0 75 5 1 0 24 20 1 0 33 29 1 0 65 61 1 0 76 72 1 0 1 77 1 0 1 78 1 0 1 79 1 0 2 80 1 1 3 81 1 0 3 82 1 0 3 83 1 0 4 84 1 0 4 85 1 0 5 86 1 1 6 87 1 0 9 88 1 6 10 89 1 0 10 90 1 0 11 91 1 0 11 92 1 0 12 93 1 0 12 94 1 0 15 95 1 0 15 96 1 0 16 97 1 0 16 98 1 0 17 99 1 0 20100 1 6 21101 1 0 21102 1 0 22103 1 0 22104 1 0 23105 1 0 23106 1 0 27107 1 6 28108 1 0 28109 1 0 30110 1 0 32111 1 0 33112 1 0 34113 1 0 37114 1 6 38115 1 0 38116 1 0 39117 1 6 40118 1 0 40119 1 0 40120 1 0 41121 1 0 41122 1 0 41123 1 0 42124 1 0 45125 1 0 45126 1 0 46127 1 0 49128 1 6 50129 1 0 50130 1 0 53131 1 0 54132 1 0 57133 1 0 57134 1 0 58135 1 0 62136 1 0 66137 1 6 67138 1 0 67139 1 0 68140 1 0 69141 1 0 73142 1 0 M END