RDKit 3D 130138 0 0 0 0 0 0 0 0999 V2000 12.0024 0.3143 1.1381 C 0 0 0 0 0 0 0 0 0 0 0 0 10.5123 0.2001 1.3445 C 0 0 2 0 0 0 0 0 0 0 0 0 10.0972 0.5756 2.7550 C 0 0 0 0 0 0 0 0 0 0 0 0 8.8111 -0.0859 3.1519 C 0 0 0 0 0 0 0 0 0 0 0 0 8.0041 -0.3636 1.9148 C 0 0 2 0 0 0 0 0 0 0 0 0 8.6534 -1.3230 1.0404 N 0 0 0 0 0 0 0 0 0 0 0 0 10.0978 -1.2150 1.0509 C 0 0 0 0 0 0 0 0 0 0 0 0 7.6832 0.7534 1.1896 O 0 0 0 0 0 0 0 0 0 0 0 0 6.4470 0.6172 0.6130 C 0 0 2 0 0 0 0 0 0 0 0 0 5.4317 1.5142 1.2876 C 0 0 0 0 0 0 0 0 0 0 0 0 4.2153 0.6397 1.5988 C 0 0 1 0 0 0 0 0 0 0 0 0 2.9324 1.2931 1.2461 C 0 0 2 0 0 0 0 0 0 0 0 0 1.8943 1.3548 2.3169 C 0 0 0 0 0 0 0 0 0 0 0 0 0.5199 0.9421 1.8886 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0595 1.5503 0.5797 C 0 0 2 0 0 0 0 0 0 0 0 0 -0.9960 0.5839 0.0559 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.4763 0.8676 -1.3191 C 0 0 1 0 0 0 0 0 0 0 0 0 -2.8190 1.0452 -1.5009 O 0 0 0 0 0 0 0 0 0 0 0 0 -3.4331 0.1229 -2.3247 C 0 0 2 0 0 0 0 0 0 0 0 0 -3.7373 0.8271 -3.5007 O 0 0 0 0 0 0 0 0 0 0 0 0 -4.4050 0.0895 -4.4446 C 0 0 1 0 0 0 0 0 0 0 0 0 -3.6225 -1.1057 -4.9338 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.4220 -0.7222 -5.5277 O 0 0 0 0 0 0 0 0 0 0 0 0 -5.7650 -0.2548 -3.9520 C 0 0 2 0 0 0 0 0 0 0 0 0 -6.7138 0.5340 -4.5942 O 0 0 0 0 0 0 0 0 0 0 0 0 -5.9268 -0.0404 -2.4609 C 0 0 2 0 0 0 0 0 0 0 0 0 -6.2633 1.2430 -2.1640 O 0 0 0 0 0 0 0 0 0 0 0 0 -7.5094 1.3584 -1.5277 C 0 0 2 0 0 0 0 0 0 0 0 0 -8.3522 2.0904 -2.3444 O 0 0 0 0 0 0 0 0 0 0 0 0 -9.6506 2.1849 -1.9287 C 0 0 0 0 0 0 0 0 0 0 0 0 -9.7941 2.0861 -0.4404 C 0 0 1 0 0 0 0 0 0 0 0 0 -9.9192 0.7399 -0.0872 O 0 0 0 0 0 0 0 0 0 0 0 0 -8.5881 2.7238 0.2008 C 0 0 2 0 0 0 0 0 0 0 0 0 -8.5055 4.0242 -0.3214 O 0 0 0 0 0 0 0 0 0 0 0 0 -7.3237 2.0034 -0.1737 C 0 0 1 0 0 0 0 0 0 0 0 0 -7.1081 0.9938 0.7576 O 0 0 0 0 0 0 0 0 0 0 0 0 -4.6458 -0.5382 -1.7781 C 0 0 2 0 0 0 0 0 0 0 0 0 -4.7747 -0.6442 -0.4345 O 0 0 0 0 0 0 0 0 0 0 0 0 -4.8711 -1.9155 0.0774 C 0 0 2 0 0 0 0 0 0 0 0 0 -6.0914 -1.9415 0.7981 O 0 0 0 0 0 0 0 0 0 0 0 0 -6.4494 -3.2564 1.0885 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.2360 -3.9868 1.6449 C 0 0 2 0 0 0 0 0 0 0 0 0 -5.6424 -4.8704 2.6631 O 0 0 0 0 0 0 0 0 0 0 0 0 -4.3568 -2.9124 2.2902 C 0 0 2 0 0 0 0 0 0 0 0 0 -5.0849 -2.0904 3.1165 O 0 0 0 0 0 0 0 0 0 0 0 0 -3.7915 -2.0979 1.1171 C 0 0 1 0 0 0 0 0 0 0 0 0 -2.6952 -2.7810 0.6495 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.6409 1.9360 -2.0184 C 0 0 0 0 0 0 0 0 0 0 0 0 0.8156 1.4945 -1.8310 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2214 1.7004 -0.4113 C 0 0 1 0 0 0 0 0 0 0 0 0 1.7081 3.1541 -0.3103 C 0 0 0 0 0 0 0 0 0 0 0 0 2.2505 0.7204 0.0278 C 0 0 1 0 0 0 0 0 0 0 0 0 3.2960 0.3580 -0.9646 C 0 0 0 0 0 0 0 0 0 0 0 0 3.9736 -0.8791 -0.4095 C 0 0 0 0 0 0 0 0 0 0 0 0 4.4658 -0.7049 1.0006 C 0 0 2 0 0 0 0 0 0 0 0 0 3.9042 -1.7705 1.9126 C 0 0 0 0 0 0 0 0 0 0 0 0 5.9576 -0.7832 0.9404 C 0 0 2 0 0 0 0 0 0 0 0 0 6.6368 -0.9734 2.2783 C 0 0 1 0 0 0 0 0 0 0 0 0 6.8057 -2.3991 2.6846 C 0 0 0 0 0 0 0 0 0 0 0 0 12.2367 0.9429 0.2429 H 0 0 0 0 0 0 0 0 0 0 0 0 12.4515 -0.6689 0.9763 H 0 0 0 0 0 0 0 0 0 0 0 0 12.4872 0.7837 2.0123 H 0 0 0 0 0 0 0 0 0 0 0 0 10.0152 0.9045 0.6380 H 0 0 0 0 0 0 0 0 0 0 0 0 10.8700 0.2709 3.4938 H 0 0 0 0 0 0 0 0 0 0 0 0 9.9376 1.6817 2.7792 H 0 0 0 0 0 0 0 0 0 0 0 0 8.2255 0.6267 3.7758 H 0 0 0 0 0 0 0 0 0 0 0 0 8.9771 -1.0584 3.6549 H 0 0 0 0 0 0 0 0 0 0 0 0 8.3002 -1.2850 0.0728 H 0 0 0 0 0 0 0 0 0 0 0 0 10.4610 -1.4547 0.0115 H 0 0 0 0 0 0 0 0 0 0 0 0 10.5971 -1.9153 1.7231 H 0 0 0 0 0 0 0 0 0 0 0 0 6.3935 0.7505 -0.4659 H 0 0 0 0 0 0 0 0 0 0 0 0 5.9033 1.9166 2.2198 H 0 0 0 0 0 0 0 0 0 0 0 0 5.1609 2.3950 0.6894 H 0 0 0 0 0 0 0 0 0 0 0 0 4.2254 0.5112 2.7189 H 0 0 0 0 0 0 0 0 0 0 0 0 3.1889 2.3634 0.9852 H 0 0 0 0 0 0 0 0 0 0 0 0 2.1655 0.6949 3.1692 H 0 0 0 0 0 0 0 0 0 0 0 0 1.8006 2.3756 2.7915 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.1879 1.3232 2.6825 H 0 0 0 0 0 0 0 0 0 0 0 0 0.3711 -0.1581 1.9095 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.3507 2.5372 0.8016 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.7884 0.5660 0.8232 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.4900 -0.4251 0.1501 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.2288 -0.0552 -1.9361 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.6658 -0.6105 -2.6413 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.5089 0.7537 -5.3379 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.1970 -1.6589 -5.7001 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.3435 -1.8184 -4.1379 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.4654 0.2006 -5.8369 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.9773 -1.3090 -4.2354 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.3256 1.3003 -5.0866 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.7272 -0.7297 -2.1265 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.9851 0.3752 -1.3801 H 0 0 0 0 0 0 0 0 0 0 0 0 -10.1563 3.1182 -2.2551 H 0 0 0 0 0 0 0 0 0 0 0 0 -10.2452 1.3522 -2.3712 H 0 0 0 0 0 0 0 0 0 0 0 0 -10.7414 2.5656 -0.1124 H 0 0 0 0 0 0 0 0 0 0 0 0 -10.4801 0.2409 -0.7245 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.7767 2.7304 1.2987 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.9189 4.0278 -1.1071 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.5033 2.7384 -0.1984 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.9041 0.5286 1.0524 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.6273 -1.6146 -2.1487 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.8212 -2.7217 -0.6506 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.7004 -3.7337 0.1263 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.3247 -3.3304 1.7311 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.6746 -4.5030 0.8498 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.5616 -5.1696 2.5492 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.5007 -3.3798 2.7879 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.0048 -2.4142 3.1887 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.4416 -1.1002 1.4871 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.8473 -2.3016 0.7261 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.8289 2.9450 -1.6736 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.8240 1.9052 -3.1132 H 0 0 0 0 0 0 0 0 0 0 0 0 1.4172 2.1589 -2.4948 H 0 0 0 0 0 0 0 0 0 0 0 0 0.9046 0.4791 -2.2166 H 0 0 0 0 0 0 0 0 0 0 0 0 2.7003 3.3015 -0.7402 H 0 0 0 0 0 0 0 0 0 0 0 0 1.0098 3.7549 -0.9489 H 0 0 0 0 0 0 0 0 0 0 0 0 1.5558 3.5316 0.7102 H 0 0 0 0 0 0 0 0 0 0 0 0 1.7023 -0.2284 0.2749 H 0 0 0 0 0 0 0 0 0 0 0 0 2.8805 0.0757 -1.9557 H 0 0 0 0 0 0 0 0 0 0 0 0 4.0476 1.1519 -1.0214 H 0 0 0 0 0 0 0 0 0 0 0 0 4.7654 -1.1642 -1.1277 H 0 0 0 0 0 0 0 0 0 0 0 0 3.2135 -1.6912 -0.4277 H 0 0 0 0 0 0 0 0 0 0 0 0 3.9495 -2.7758 1.4738 H 0 0 0 0 0 0 0 0 0 0 0 0 4.4193 -1.7877 2.8790 H 0 0 0 0 0 0 0 0 0 0 0 0 2.8274 -1.5519 2.1397 H 0 0 0 0 0 0 0 0 0 0 0 0 6.2905 -1.5494 0.2446 H 0 0 0 0 0 0 0 0 0 0 0 0 6.2269 -0.3137 3.0601 H 0 0 0 0 0 0 0 0 0 0 0 0 6.5035 -2.5887 3.7553 H 0 0 0 0 0 0 0 0 0 0 0 0 7.8934 -2.6907 2.6652 H 0 0 0 0 0 0 0 0 0 0 0 0 6.2631 -3.1029 2.0395 H 0 0 0 0 0 0 0 0 0 0 0 0 59 58 1 0 58 57 1 0 57 9 1 0 9 10 1 0 10 11 1 0 11 12 1 0 12 13 1 0 13 14 1 0 14 15 1 0 15 16 1 0 16 17 1 0 17 48 1 0 48 49 1 0 49 50 1 0 50 51 1 6 50 52 1 0 52 53 1 0 53 54 1 0 54 55 1 0 55 56 1 1 17 18 1 0 18 19 1 0 19 20 1 0 20 21 1 0 21 22 1 0 22 23 1 0 21 24 1 0 24 25 1 0 24 26 1 0 26 27 1 0 27 28 1 0 28 29 1 0 29 30 1 0 30 31 1 0 31 32 1 0 31 33 1 0 33 34 1 0 33 35 1 0 35 36 1 0 26 37 1 0 37 38 1 0 38 39 1 0 39 40 1 0 40 41 1 0 41 42 1 0 42 43 1 0 42 44 1 0 44 45 1 0 44 46 1 0 46 47 1 0 9 8 1 0 5 8 1 6 5 4 1 0 4 3 1 0 3 2 1 0 2 1 1 0 2 7 1 0 7 6 1 0 5 58 1 0 6 5 1 0 55 57 1 0 37 19 1 0 46 39 1 0 55 11 1 0 35 28 1 0 52 12 1 0 50 15 1 0 59128 1 0 59129 1 0 59130 1 0 58127 1 1 57126 1 6 9 71 1 6 10 72 1 0 10 73 1 0 11 74 1 1 12 75 1 6 13 76 1 0 13 77 1 0 14 78 1 0 14 79 1 0 15 80 1 1 16 81 1 0 16 82 1 0 17 83 1 6 48111 1 0 48112 1 0 49113 1 0 49114 1 0 51115 1 0 51116 1 0 51117 1 0 52118 1 1 53119 1 0 53120 1 0 54121 1 0 54122 1 0 56123 1 0 56124 1 0 56125 1 0 19 84 1 6 21 85 1 6 22 86 1 0 22 87 1 0 23 88 1 0 24 89 1 1 25 90 1 0 26 91 1 1 28 92 1 1 30 93 1 0 30 94 1 0 31 95 1 1 32 96 1 0 33 97 1 1 34 98 1 0 35 99 1 6 36100 1 0 37101 1 6 39102 1 6 41103 1 0 41104 1 0 42105 1 6 43106 1 0 44107 1 1 45108 1 0 46109 1 1 47110 1 0 4 66 1 0 4 67 1 0 3 64 1 0 3 65 1 0 2 63 1 6 1 60 1 0 1 61 1 0 1 62 1 0 7 69 1 0 7 70 1 0 6 68 1 0 M END