RDKit 3D 174183 0 0 0 0 0 0 0 0999 V2000 -0.3267 -3.5975 -2.7442 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.8556 -2.4849 -3.0494 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.0320 -1.6799 -1.9343 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.5286 -2.0681 -0.6791 C 0 0 2 0 0 0 0 0 0 0 0 0 0.9196 -2.1465 -0.7458 C 0 0 0 0 0 0 0 0 0 0 0 0 1.4409 -2.3336 0.4253 O 0 0 0 0 0 0 0 0 0 0 0 0 1.9026 -2.0578 -1.7714 C 0 0 0 0 0 0 0 0 0 0 0 0 1.6629 -1.7262 -2.9867 O 0 0 0 0 0 0 0 0 0 0 0 0 3.3137 -2.3090 -1.5961 C 0 0 0 0 0 0 0 0 0 0 0 0 4.2247 -1.9828 -2.6162 C 0 0 0 0 0 0 0 0 0 0 0 0 5.5763 -2.1915 -2.5444 C 0 0 0 0 0 0 0 0 0 0 0 0 6.4171 -1.8457 -3.5801 O 0 0 0 0 0 0 0 0 0 0 0 0 6.1384 -2.7601 -1.4149 C 0 0 0 0 0 0 0 0 0 0 0 0 7.5008 -2.9795 -1.3321 O 0 0 0 0 0 0 0 0 0 0 0 0 5.2705 -3.0957 -0.3902 C 0 0 0 0 0 0 0 0 0 0 0 0 5.8326 -3.6802 0.7480 O 0 0 0 0 0 0 0 0 0 0 0 0 3.8985 -2.8745 -0.4844 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.9986 -3.4643 -0.3731 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.0695 -3.9439 -0.9253 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.4781 -4.4996 0.4876 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.3769 -5.1843 1.3612 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.9285 -6.2005 2.1393 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.8413 -6.8531 2.9948 O 0 0 0 0 0 0 0 0 0 0 0 0 0.3840 -6.6107 2.1196 C 0 0 0 0 0 0 0 0 0 0 0 0 0.8057 -7.6634 2.9616 O 0 0 0 0 0 0 0 0 0 0 0 0 1.2400 -5.9574 1.2738 C 0 0 0 0 0 0 0 0 0 0 0 0 2.5783 -6.3376 1.2160 O 0 0 0 0 0 0 0 0 0 0 0 0 0.7997 -4.9263 0.4784 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.0319 -1.0657 0.4341 C 0 0 2 0 0 0 0 0 0 0 0 0 -0.2242 -1.3575 1.4669 O 0 0 0 0 0 0 0 0 0 0 0 0 0.0142 -1.1465 2.7269 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.7984 -0.3018 3.1480 O 0 0 0 0 0 0 0 0 0 0 0 0 0.9104 -1.5931 3.7781 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0588 -2.3504 3.5757 C 0 0 0 0 0 0 0 0 0 0 0 0 2.7592 -2.8927 4.6363 C 0 0 0 0 0 0 0 0 0 0 0 0 3.8977 -3.6614 4.4358 O 0 0 0 0 0 0 0 0 0 0 0 0 2.3477 -2.6949 5.9152 C 0 0 0 0 0 0 0 0 0 0 0 0 3.0791 -3.2549 6.9830 O 0 0 0 0 0 0 0 0 0 0 0 0 1.1926 -1.9389 6.2282 C 0 0 0 0 0 0 0 0 0 0 0 0 0.8044 -1.7601 7.5026 O 0 0 0 0 0 0 0 0 0 0 0 0 0.5594 -1.4395 5.0750 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.4306 -1.6319 0.5196 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.8554 -1.6880 -0.7512 O 0 0 0 0 0 0 0 0 0 0 0 0 -3.4055 -2.1057 1.3693 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.5359 -1.9373 2.6967 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.3998 -2.3787 3.6457 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.3796 -2.1078 4.9408 O 0 0 0 0 0 0 0 0 0 0 0 0 -5.4516 -3.2493 3.0993 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.3921 -3.7816 3.9096 O 0 0 0 0 0 0 0 0 0 0 0 0 -5.3570 -3.4369 1.7823 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.4008 -4.3176 1.2106 O 0 0 0 0 0 0 0 0 0 0 0 0 -4.4897 -2.9837 0.8789 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.3024 0.3774 0.0128 C 0 0 1 0 0 0 0 0 0 0 0 0 -2.1779 0.0568 -1.1583 O 0 0 0 0 0 0 0 0 0 0 0 0 -3.1544 0.8316 -1.6511 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.3032 1.9377 -1.0926 O 0 0 0 0 0 0 0 0 0 0 0 0 -4.0910 0.6174 -2.7407 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.3196 -0.4715 -3.4476 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.1323 -0.8007 -4.5028 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.3181 -1.8788 -5.1489 O 0 0 0 0 0 0 0 0 0 0 0 0 -5.9202 0.4179 -4.8902 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.7788 0.1721 -5.9483 O 0 0 0 0 0 0 0 0 0 0 0 0 -5.7474 1.5332 -4.2374 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.5092 2.6782 -4.6313 O 0 0 0 0 0 0 0 0 0 0 0 0 -4.8772 1.7572 -3.1600 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.4400 0.9078 0.8714 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.6332 0.3486 0.4959 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.7969 1.7721 1.9235 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.1398 2.0243 2.2271 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.5328 2.8598 3.2310 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.9319 3.0326 3.4251 O 0 0 0 0 0 0 0 0 0 0 0 0 -3.6653 3.5089 4.0191 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.0173 4.3564 5.0554 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.2755 3.3169 3.7935 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.4037 3.9910 4.6060 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.9844 2.4639 2.7648 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.2536 1.3751 -0.2278 C 0 0 1 0 0 0 0 0 0 0 0 0 0.4020 1.5999 1.0354 O 0 0 0 0 0 0 0 0 0 0 0 0 1.4235 2.4300 1.3132 C 0 0 0 0 0 0 0 0 0 0 0 0 1.8597 3.1096 0.3636 O 0 0 0 0 0 0 0 0 0 0 0 0 2.1171 2.6680 2.5694 C 0 0 0 0 0 0 0 0 0 0 0 0 1.8230 2.0971 3.7734 C 0 0 0 0 0 0 0 0 0 0 0 0 2.5756 2.3690 4.9303 C 0 0 0 0 0 0 0 0 0 0 0 0 2.2254 1.7534 6.1175 O 0 0 0 0 0 0 0 0 0 0 0 0 3.6482 3.2301 4.8810 C 0 0 0 0 0 0 0 0 0 0 0 0 4.4085 3.5139 6.0251 O 0 0 0 0 0 0 0 0 0 0 0 0 3.9319 3.7887 3.6740 C 0 0 0 0 0 0 0 0 0 0 0 0 5.0317 4.6489 3.6155 O 0 0 0 0 0 0 0 0 0 0 0 0 3.2111 3.5417 2.5397 C 0 0 0 0 0 0 0 0 0 0 0 0 0.9041 1.0630 -1.0754 C 0 0 0 0 0 0 0 0 0 0 0 0 0.6705 0.9608 -2.3405 O 0 0 0 0 0 0 0 0 0 0 0 0 2.3051 0.8585 -0.8442 C 0 0 0 0 0 0 0 0 0 0 0 0 2.9587 0.3892 0.2643 C 0 0 0 0 0 0 0 0 0 0 0 0 4.3068 0.3760 0.4657 C 0 0 0 0 0 0 0 0 0 0 0 0 4.9397 -0.1092 1.5862 O 0 0 0 0 0 0 0 0 0 0 0 0 5.1685 0.8840 -0.5494 C 0 0 0 0 0 0 0 0 0 0 0 0 6.5201 0.8839 -0.3666 O 0 0 0 0 0 0 0 0 0 0 0 0 4.6022 1.3606 -1.6762 C 0 0 0 0 0 0 0 0 0 0 0 0 5.2232 1.8944 -2.7711 O 0 0 0 0 0 0 0 0 0 0 0 0 3.2159 1.3430 -1.8101 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.6297 2.7050 -0.7728 C 0 0 2 0 0 0 0 0 0 0 0 0 -1.3669 3.6246 -0.1460 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.6544 2.9656 -2.2266 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.0687 2.2196 -3.1508 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.1421 4.2380 -2.8071 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.2470 4.5049 -4.1345 C 0 0 0 0 0 0 0 0 0 0 0 0 0.2671 5.6189 -4.7942 C 0 0 0 0 0 0 0 0 0 0 0 0 0.1709 5.8993 -6.1134 O 0 0 0 0 0 0 0 0 0 0 0 0 0.9596 6.5378 -3.9533 C 0 0 0 0 0 0 0 0 0 0 0 0 1.5158 7.6952 -4.5651 O 0 0 0 0 0 0 0 0 0 0 0 0 1.0682 6.3036 -2.6621 C 0 0 0 0 0 0 0 0 0 0 0 0 1.7567 7.1983 -1.7820 O 0 0 0 0 0 0 0 0 0 0 0 0 0.5424 5.1629 -2.0082 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.1378 -2.2961 -4.4120 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.9560 -3.3866 -5.2690 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.1472 -3.2928 -6.6428 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.9843 -4.3641 -7.4788 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.5205 -2.0900 -7.1661 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.7334 -1.8808 -8.5352 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.6952 -1.0181 -6.3303 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.0719 0.2328 -6.8341 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.5166 -1.0971 -4.9804 C 0 0 0 0 0 0 0 0 0 0 0 0 3.8224 -1.5210 -3.4986 H 0 0 0 0 0 0 0 0 0 0 0 0 6.1078 -1.4446 -4.4552 H 0 0 0 0 0 0 0 0 0 0 0 0 8.0613 -2.7126 -2.1459 H 0 0 0 0 0 0 0 0 0 0 0 0 6.8490 -3.8353 0.8090 H 0 0 0 0 0 0 0 0 0 0 0 0 3.3521 -3.1892 0.3628 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.4283 -4.8531 1.3672 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.8132 -6.5756 3.0127 H 0 0 0 0 0 0 0 0 0 0 0 0 0.1122 -8.0524 3.5852 H 0 0 0 0 0 0 0 0 0 0 0 0 2.9004 -7.0719 1.7955 H 0 0 0 0 0 0 0 0 0 0 0 0 1.5405 -4.5158 -0.2698 H 0 0 0 0 0 0 0 0 0 0 0 0 2.4301 -2.4915 2.5996 H 0 0 0 0 0 0 0 0 0 0 0 0 4.4182 -4.0525 5.1774 H 0 0 0 0 0 0 0 0 0 0 0 0 2.8341 -3.1136 7.9488 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0497 -1.2839 7.9350 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.3427 -0.8487 5.3779 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.7871 -1.2293 3.2185 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.8052 -2.2639 5.7765 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.4593 -3.6445 4.8841 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.0473 -4.7030 1.8482 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.4892 -3.1676 -0.1394 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.6932 -1.3659 -3.1429 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.5443 -2.5877 -5.6938 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.8908 -0.7036 -6.4231 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.1354 2.6249 -5.3955 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.8388 2.6928 -2.7207 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.9749 1.5859 1.6641 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.2307 3.6293 4.1386 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.9720 4.5191 5.2645 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.4288 3.9715 4.5911 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.8708 2.3617 2.6999 H 0 0 0 0 0 0 0 0 0 0 0 0 1.0272 1.4378 3.9024 H 0 0 0 0 0 0 0 0 0 0 0 0 1.4708 1.1490 6.3063 H 0 0 0 0 0 0 0 0 0 0 0 0 4.1792 3.0463 6.9021 H 0 0 0 0 0 0 0 0 0 0 0 0 5.5998 4.8317 4.4131 H 0 0 0 0 0 0 0 0 0 0 0 0 3.5265 4.0450 1.6192 H 0 0 0 0 0 0 0 0 0 0 0 0 2.3947 -0.0451 1.1023 H 0 0 0 0 0 0 0 0 0 0 0 0 5.9291 -0.1223 1.6442 H 0 0 0 0 0 0 0 0 0 0 0 0 7.1304 1.2763 -1.0549 H 0 0 0 0 0 0 0 0 0 0 0 0 6.2489 1.9246 -2.9337 H 0 0 0 0 0 0 0 0 0 0 0 0 2.8017 1.7375 -2.7561 H 0 0 0 0 0 0 0 0 0 0 0 0 0.4185 3.2235 -0.6293 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.8323 4.2776 -0.7414 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.7897 3.8359 -4.8230 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.2851 5.2626 -6.7331 H 0 0 0 0 0 0 0 0 0 0 0 0 1.4572 7.8497 -5.5319 H 0 0 0 0 0 0 0 0 0 0 0 0 2.1319 8.0436 -2.2311 H 0 0 0 0 0 0 0 0 0 0 0 0 0.6851 5.0744 -0.9829 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.6492 -4.3590 -4.9097 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.7414 -5.2692 -7.1290 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.5269 -2.6672 -9.1638 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.1860 0.3178 -7.8082 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.6235 -0.2728 -4.3177 H 0 0 0 0 0 0 0 0 0 0 0 0 102101 1 0 101103 1 0 103104 2 0 103105 1 0 105106 2 0 106107 1 0 107108 1 0 107109 2 0 109110 1 0 109111 1 0 111112 1 0 111113 2 0 101 77 1 0 77 78 1 1 78 79 1 0 79 80 2 0 79 81 1 0 81 82 2 0 82 83 1 0 83 84 1 0 83 85 2 0 85 86 1 0 85 87 1 0 87 88 1 0 87 89 2 0 77 90 1 0 90 91 2 0 90 92 1 0 92 93 2 0 93 94 1 0 94 95 1 0 94 96 2 0 96 97 1 0 96 98 1 0 98 99 1 0 98100 2 0 77 53 1 0 53 54 1 6 54 55 1 0 55 56 2 0 55 57 1 0 57 58 2 0 58 59 1 0 59 60 1 0 59 61 2 0 61 62 1 0 61 63 1 0 63 64 1 0 63 65 2 0 53 66 1 0 66 67 2 0 66 68 1 0 68 69 2 0 69 70 1 0 70 71 1 0 70 72 2 0 72 73 1 0 72 74 1 0 74 75 1 0 74 76 2 0 53 29 1 0 29 30 1 1 30 31 1 0 31 32 2 0 31 33 1 0 33 34 2 0 34 35 1 0 35 36 1 0 35 37 2 0 37 38 1 0 37 39 1 0 39 40 1 0 39 41 2 0 29 42 1 0 42 43 2 0 42 44 1 0 44 45 2 0 45 46 1 0 46 47 1 0 46 48 2 0 48 49 1 0 48 50 1 0 50 51 1 0 50 52 2 0 29 4 1 0 4 3 1 6 3 2 1 0 2 1 2 0 2114 1 0 114115 2 0 115116 1 0 116117 1 0 116118 2 0 118119 1 0 118120 1 0 120121 1 0 120122 2 0 4 5 1 0 5 6 2 0 5 7 1 0 7 8 2 0 7 9 1 0 9 10 2 0 10 11 1 0 11 12 1 0 11 13 2 0 13 14 1 0 13 15 1 0 15 16 1 0 15 17 2 0 4 18 1 0 18 19 2 0 18 20 1 0 20 21 2 0 21 22 1 0 22 23 1 0 22 24 2 0 24 25 1 0 24 26 1 0 26 27 1 0 26 28 2 0 113105 1 0 89 81 1 0 100 92 1 0 65 57 1 0 76 68 1 0 41 33 1 0 52 44 1 0 122114 1 0 17 9 1 0 28 20 1 0 102164 1 0 101163 1 1 106165 1 0 108166 1 0 110167 1 0 112168 1 0 113169 1 0 82153 1 0 84154 1 0 86155 1 0 88156 1 0 89157 1 0 93158 1 0 95159 1 0 97160 1 0 99161 1 0 100162 1 0 58143 1 0 60144 1 0 62145 1 0 64146 1 0 65147 1 0 69148 1 0 71149 1 0 73150 1 0 75151 1 0 76152 1 0 34133 1 0 36134 1 0 38135 1 0 40136 1 0 41137 1 0 45138 1 0 47139 1 0 49140 1 0 51141 1 0 52142 1 0 115170 1 0 117171 1 0 119172 1 0 121173 1 0 122174 1 0 10123 1 0 12124 1 0 14125 1 0 16126 1 0 17127 1 0 21128 1 0 23129 1 0 25130 1 0 27131 1 0 28132 1 0 M END