RDKit 3D 123123 0 0 0 0 0 0 0 0999 V2000 10.9973 -0.1073 -1.5388 C 0 0 0 0 0 0 0 0 0 0 0 0 10.4027 1.2315 -1.2190 C 0 0 0 0 0 0 0 0 0 0 0 0 8.9437 1.3527 -1.5243 C 0 0 0 0 0 0 0 0 0 0 0 0 8.1705 0.3564 -0.7232 C 0 0 2 0 0 0 0 0 0 0 0 0 6.7032 0.5357 -1.0835 C 0 0 0 0 0 0 0 0 0 0 0 0 5.8548 -0.4185 -0.3309 C 0 0 0 0 0 0 0 0 0 0 0 0 6.0496 -1.9036 -0.4735 C 0 0 0 0 0 0 0 0 0 0 0 0 4.9143 0.0776 0.4759 C 0 0 0 0 0 0 0 0 0 0 0 0 4.0782 -0.8692 1.2179 C 0 0 1 0 0 0 0 0 0 0 0 0 4.7444 -1.1377 2.4369 O 0 0 0 0 0 0 0 0 0 0 0 0 2.7091 -0.3859 1.5749 C 0 0 1 0 0 0 0 0 0 0 0 0 2.8288 0.8479 2.4340 C 0 0 0 0 0 0 0 0 0 0 0 0 1.7373 -0.2902 0.4649 C 0 0 2 0 0 0 0 0 0 0 0 0 2.0611 0.6081 -0.6659 C 0 0 0 0 0 0 0 0 0 0 0 0 1.7495 2.0581 -0.4142 C 0 0 2 0 0 0 0 0 0 0 0 0 0.9018 2.2549 0.6635 O 0 0 0 0 0 0 0 0 0 0 0 0 1.2005 2.6646 -1.6886 C 0 0 0 0 0 0 0 0 0 0 0 0 0.7907 4.1088 -1.4787 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.6660 4.1219 -1.0776 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.4920 4.3442 -2.2949 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.7604 3.9303 -2.3800 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.5433 4.1817 -3.6301 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.4142 3.2201 -1.2475 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.9177 3.2534 -1.3892 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.4689 2.0062 -0.7024 C 0 0 2 0 0 0 0 0 0 0 0 0 -4.6868 1.7824 0.4206 O 0 0 0 0 0 0 0 0 0 0 0 0 -5.5228 0.8393 -1.6356 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.6756 -0.1009 -1.3569 C 0 0 2 0 0 0 0 0 0 0 0 0 -7.2066 0.2430 -0.0927 O 0 0 0 0 0 0 0 0 0 0 0 0 -8.4951 0.7045 0.0823 C 0 0 0 0 0 0 0 0 0 0 0 0 -8.9808 1.0439 1.4332 C 0 0 0 0 0 0 0 0 0 0 0 0 -9.2277 0.8246 -0.9217 O 0 0 0 0 0 0 0 0 0 0 0 0 -6.2084 -1.5524 -1.3343 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.2598 -2.1414 0.0486 C 0 0 1 0 0 0 0 0 0 0 0 0 -6.6180 -3.5087 0.0548 O 0 0 0 0 0 0 0 0 0 0 0 0 -7.7737 -3.9937 0.6417 C 0 0 0 0 0 0 0 0 0 0 0 0 -8.1292 -5.4423 0.6347 C 0 0 0 0 0 0 0 0 0 0 0 0 -8.5231 -3.1518 1.1893 O 0 0 0 0 0 0 0 0 0 0 0 0 -4.9999 -1.8828 0.8367 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.7456 -2.2158 0.1189 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.7656 -2.7857 1.1539 C 0 0 1 0 0 0 0 0 0 0 0 0 -3.1422 -4.2564 1.3012 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.3664 -2.7033 0.6462 C 0 0 2 0 0 0 0 0 0 0 0 0 -0.9638 -3.9142 0.0415 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.3588 -2.2552 1.6584 C 0 0 2 0 0 0 0 0 0 0 0 0 -0.5461 -2.9152 2.9998 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.3189 -0.7814 1.7464 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.0200 -0.2162 2.6417 O 0 0 0 0 0 0 0 0 0 0 0 0 0.4288 0.0364 0.9228 O 0 0 0 0 0 0 0 0 0 0 0 0 8.3223 0.5338 0.6662 O 0 0 0 0 0 0 0 0 0 0 0 0 8.7106 -0.4935 1.4886 C 0 0 0 0 0 0 0 0 0 0 0 0 8.8563 -0.2418 2.9541 C 0 0 0 0 0 0 0 0 0 0 0 0 8.9531 -1.6519 1.0622 O 0 0 0 0 0 0 0 0 0 0 0 0 12.0092 -0.1301 -1.0407 H 0 0 0 0 0 0 0 0 0 0 0 0 10.4234 -0.9308 -1.1223 H 0 0 0 0 0 0 0 0 0 0 0 0 11.1160 -0.2560 -2.6331 H 0 0 0 0 0 0 0 0 0 0 0 0 10.9684 2.0207 -1.7560 H 0 0 0 0 0 0 0 0 0 0 0 0 10.5065 1.3677 -0.1060 H 0 0 0 0 0 0 0 0 0 0 0 0 8.6117 2.3910 -1.3824 H 0 0 0 0 0 0 0 0 0 0 0 0 8.7321 1.1123 -2.6086 H 0 0 0 0 0 0 0 0 0 0 0 0 8.4199 -0.6781 -0.9993 H 0 0 0 0 0 0 0 0 0 0 0 0 6.3380 1.5506 -0.9345 H 0 0 0 0 0 0 0 0 0 0 0 0 6.6227 0.3049 -2.1809 H 0 0 0 0 0 0 0 0 0 0 0 0 6.2769 -2.2868 0.5377 H 0 0 0 0 0 0 0 0 0 0 0 0 5.1569 -2.3928 -0.9133 H 0 0 0 0 0 0 0 0 0 0 0 0 6.8798 -2.0478 -1.1910 H 0 0 0 0 0 0 0 0 0 0 0 0 4.8025 1.1528 0.5535 H 0 0 0 0 0 0 0 0 0 0 0 0 3.9882 -1.8572 0.7078 H 0 0 0 0 0 0 0 0 0 0 0 0 5.4574 -0.4684 2.6116 H 0 0 0 0 0 0 0 0 0 0 0 0 2.2959 -1.1756 2.2799 H 0 0 0 0 0 0 0 0 0 0 0 0 3.2781 1.7058 1.9340 H 0 0 0 0 0 0 0 0 0 0 0 0 1.8699 1.0256 2.9232 H 0 0 0 0 0 0 0 0 0 0 0 0 3.5434 0.5671 3.2639 H 0 0 0 0 0 0 0 0 0 0 0 0 1.6280 -1.3310 0.0369 H 0 0 0 0 0 0 0 0 0 0 0 0 3.0756 0.5513 -1.0694 H 0 0 0 0 0 0 0 0 0 0 0 0 1.3986 0.2771 -1.5238 H 0 0 0 0 0 0 0 0 0 0 0 0 2.7069 2.6207 -0.2078 H 0 0 0 0 0 0 0 0 0 0 0 0 1.0014 3.2173 0.9285 H 0 0 0 0 0 0 0 0 0 0 0 0 0.3896 2.0580 -2.1177 H 0 0 0 0 0 0 0 0 0 0 0 0 2.0274 2.6714 -2.4374 H 0 0 0 0 0 0 0 0 0 0 0 0 0.8937 4.6599 -2.4538 H 0 0 0 0 0 0 0 0 0 0 0 0 1.4123 4.6236 -0.7480 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.8899 3.1557 -0.5908 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.8618 4.9848 -0.4027 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0215 4.8640 -3.1264 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.8876 3.2508 -4.0957 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.3952 4.8701 -3.3815 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.9384 4.7327 -4.3785 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.1300 3.7345 -0.2977 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.0835 2.1631 -1.2638 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.3497 4.1489 -0.9177 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.2375 3.2523 -2.4592 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.5026 2.2577 -0.3793 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.8614 2.5173 1.0575 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.5593 0.2728 -1.5360 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.5772 1.2360 -2.6801 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.4582 0.0639 -2.1413 H 0 0 0 0 0 0 0 0 0 0 0 0 -9.3322 2.0903 1.4347 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.1540 0.9836 2.1640 H 0 0 0 0 0 0 0 0 0 0 0 0 -9.8102 0.3632 1.6973 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.1836 -1.5526 -1.7591 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.8402 -2.1016 -2.0580 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.0798 -1.6099 0.5906 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.8109 -5.8582 -0.3506 H 0 0 0 0 0 0 0 0 0 0 0 0 -9.1939 -5.6119 0.7890 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.4984 -5.9400 1.3995 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.0895 -2.5118 1.7705 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.9460 -0.8386 1.2066 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.8477 -3.0010 -0.6508 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.2400 -1.3354 -0.3210 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.9522 -2.2802 2.1041 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.4685 -4.6623 0.3036 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.9021 -4.4138 2.0721 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.2292 -4.8018 1.5823 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.3296 -1.9514 -0.1955 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.1599 -4.2875 0.4665 H 0 0 0 0 0 0 0 0 0 0 0 0 0.6470 -2.6092 1.2856 H 0 0 0 0 0 0 0 0 0 0 0 0 0.2407 -2.5383 3.6875 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.3857 -3.9949 2.8912 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.5079 -2.7218 3.4725 H 0 0 0 0 0 0 0 0 0 0 0 0 9.5845 0.6082 3.0393 H 0 0 0 0 0 0 0 0 0 0 0 0 7.8631 0.0457 3.3502 H 0 0 0 0 0 0 0 0 0 0 0 0 9.2387 -1.1421 3.4621 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 2 3 1 0 3 4 1 0 4 5 1 0 5 6 1 0 6 7 1 0 6 8 2 0 8 9 1 0 9 10 1 0 9 11 1 0 11 12 1 0 11 13 1 0 13 14 1 0 14 15 1 0 15 16 1 0 15 17 1 0 17 18 1 0 18 19 1 0 19 20 1 0 20 21 2 0 21 22 1 0 21 23 1 0 23 24 1 0 24 25 1 0 25 26 1 0 25 27 1 0 27 28 1 0 28 33 1 0 33 34 1 0 34 39 1 0 39 40 1 0 40 41 1 0 41 42 1 0 41 43 1 0 43 44 1 0 43 45 1 0 45 46 1 0 45 47 1 0 47 48 2 0 47 49 1 0 34 35 1 0 35 36 1 0 36 37 1 0 36 38 2 0 28 29 1 0 29 30 1 0 30 31 1 0 30 32 2 0 4 50 1 0 50 51 1 0 51 52 1 0 51 53 2 0 49 13 1 0 1 54 1 0 1 55 1 0 1 56 1 0 2 57 1 0 2 58 1 0 3 59 1 0 3 60 1 0 4 61 1 6 5 62 1 0 5 63 1 0 7 64 1 0 7 65 1 0 7 66 1 0 8 67 1 0 9 68 1 6 10 69 1 0 11 70 1 1 12 71 1 0 12 72 1 0 12 73 1 0 13 74 1 6 14 75 1 0 14 76 1 0 15 77 1 1 16 78 1 0 17 79 1 0 17 80 1 0 18 81 1 0 18 82 1 0 19 83 1 0 19 84 1 0 20 85 1 0 22 86 1 0 22 87 1 0 22 88 1 0 23 89 1 0 23 90 1 0 24 91 1 0 24 92 1 0 25 93 1 1 26 94 1 0 27 95 1 0 27 96 1 0 28 97 1 6 33101 1 0 33102 1 0 34103 1 1 39107 1 0 39108 1 0 40109 1 0 40110 1 0 41111 1 1 42112 1 0 42113 1 0 42114 1 0 43115 1 6 44116 1 0 45117 1 6 46118 1 0 46119 1 0 46120 1 0 37104 1 0 37105 1 0 37106 1 0 31 98 1 0 31 99 1 0 31100 1 0 52121 1 0 52122 1 0 52123 1 0 M END