RDKit 3D 155158 0 0 0 0 0 0 0 0999 V2000 13.1902 2.6389 -1.6704 C 0 0 0 0 0 0 0 0 0 0 0 0 13.4519 1.6169 -0.5592 C 0 0 0 0 0 0 0 0 0 0 0 0 13.2510 0.2142 -0.9705 C 0 0 2 0 0 0 0 0 0 0 0 0 14.2202 -0.0700 -2.1630 C 0 0 0 0 0 0 0 0 0 0 0 0 11.9432 -0.3005 -1.3231 C 0 0 0 0 0 0 0 0 0 0 0 0 10.8177 -0.3215 -0.2777 C 0 0 2 0 0 0 0 0 0 0 0 0 10.4781 1.0606 0.1331 C 0 0 0 0 0 0 0 0 0 0 0 0 11.2731 -1.1825 0.8283 C 0 0 0 0 0 0 0 0 0 0 0 0 10.5878 -1.5278 2.0335 C 0 0 0 0 0 0 0 0 0 0 0 0 9.3866 -2.3007 2.1914 C 0 0 0 0 0 0 0 0 0 0 0 0 7.9974 -2.1693 1.9236 C 0 0 0 0 0 0 0 0 0 0 0 0 7.1785 -1.9444 0.7663 C 0 0 0 0 0 0 0 0 0 0 0 0 7.1011 -0.6928 0.0032 C 0 0 0 0 0 0 0 0 0 0 0 0 6.6729 0.4983 0.8338 C 0 0 0 0 0 0 0 0 0 0 0 0 5.3798 0.3911 1.5215 C 0 0 0 0 0 0 0 0 0 0 0 0 4.1712 0.1977 0.7238 C 0 0 0 0 0 0 0 0 0 0 0 0 4.2319 0.1078 -0.5192 O 0 0 0 0 0 0 0 0 0 0 0 0 2.8832 0.1018 1.3138 N 0 0 0 0 0 0 0 0 0 0 0 0 1.6563 -0.1022 0.5657 C 0 0 2 0 0 0 0 0 0 0 0 0 0.7476 1.1026 0.8143 C 0 0 0 0 0 0 0 0 0 0 0 0 0.5179 1.9517 -0.3770 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.8899 2.3928 -0.5690 C 0 0 1 0 0 0 0 0 0 0 0 0 -1.5308 1.4693 -1.4205 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.6765 2.5116 0.6332 N 0 0 0 0 0 0 0 0 0 0 0 0 -3.1090 2.7404 0.6164 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.7228 2.2340 1.5775 O 0 0 0 0 0 0 0 0 0 0 0 0 -3.7361 3.4823 -0.4150 C 0 0 2 0 0 0 0 0 0 0 0 0 -4.0155 4.9457 -0.0716 C 0 0 1 0 0 0 0 0 0 0 0 0 -2.8256 5.6233 0.1800 O 0 0 0 0 0 0 0 0 0 0 0 0 -4.6247 5.3875 -1.3880 C 0 0 1 0 0 0 0 0 0 0 0 0 -3.6065 6.2328 -2.1265 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.9379 4.1274 -2.1516 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.9660 3.1172 -1.0291 N 0 0 0 0 0 0 0 0 0 0 0 0 -5.9307 2.1352 -0.7644 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.1826 1.4294 -1.8443 O 0 0 0 0 0 0 0 0 0 0 0 0 -6.7099 1.7130 0.3850 C 0 0 2 0 0 0 0 0 0 0 0 0 -7.0452 2.8155 1.3863 C 0 0 2 0 0 0 0 0 0 0 0 0 -8.0814 2.2502 2.1819 O 0 0 0 0 0 0 0 0 0 0 0 0 -7.6798 3.9793 0.6103 C 0 0 0 0 0 0 0 0 0 0 0 0 -8.9085 3.5974 -0.0888 C 0 0 0 0 0 0 0 0 0 0 0 0 -10.1742 3.7654 0.5300 N 0 0 0 0 0 0 0 0 0 0 0 0 -8.8658 3.1144 -1.2420 O 0 0 0 0 0 0 0 0 0 0 0 0 -6.3399 0.5093 1.0680 N 0 0 0 0 0 0 0 0 0 0 0 0 -6.5331 -0.8297 0.8399 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.9608 -1.5194 1.8639 O 0 0 0 0 0 0 0 0 0 0 0 0 -6.3446 -1.6583 -0.3713 C 0 0 2 0 0 0 0 0 0 0 0 0 -7.6936 -1.8201 -1.0988 C 0 0 0 0 0 0 0 0 0 0 0 0 -8.7480 -2.4373 -0.2443 C 0 0 0 0 0 0 0 0 0 0 0 0 -10.0467 -2.5853 -0.9596 C 0 0 0 0 0 0 0 0 0 0 0 0 -10.2777 -3.7730 -1.6174 C 0 0 0 0 0 0 0 0 0 0 0 0 -11.4586 -3.9858 -2.2923 C 0 0 0 0 0 0 0 0 0 0 0 0 -12.4339 -2.9958 -2.3146 C 0 0 0 0 0 0 0 0 0 0 0 0 -13.6267 -3.1569 -2.9703 O 0 0 0 0 0 0 0 0 0 0 0 0 -12.2192 -1.7999 -1.6616 C 0 0 0 0 0 0 0 0 0 0 0 0 -11.0218 -1.6161 -0.9923 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.7868 -2.9592 -0.1654 N 0 0 0 0 0 0 0 0 0 0 0 0 -4.4621 -3.4317 -0.2150 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.1752 -4.2130 -1.2161 O 0 0 0 0 0 0 0 0 0 0 0 0 -3.3165 -3.2023 0.6841 C 0 0 2 0 0 0 0 0 0 0 0 0 -3.6522 -2.9511 2.1025 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.4800 -1.4938 2.3067 C 0 0 1 0 0 0 0 0 0 0 0 0 -2.4285 -1.3066 3.2438 O 0 0 0 0 0 0 0 0 0 0 0 0 -3.0166 -0.9741 0.9655 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.4254 -2.1252 0.3000 N 0 0 0 0 0 0 0 0 0 0 0 0 -1.2841 -2.2397 -0.5464 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.4382 -1.5877 -1.6593 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.0292 -2.9305 -0.3838 C 0 0 2 0 0 0 0 0 0 0 0 0 0.0008 -4.4257 -0.4782 C 0 0 1 0 0 0 0 0 0 0 0 0 -0.1159 -5.1440 0.8368 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.7302 -4.9656 -1.5151 O 0 0 0 0 0 0 0 0 0 0 0 0 0.7472 -2.5271 0.7679 N 0 0 0 0 0 0 0 0 0 0 0 0 0.9882 -1.2478 1.2658 C 0 0 0 0 0 0 0 0 0 0 0 0 0.6213 -0.9532 2.4594 O 0 0 0 0 0 0 0 0 0 0 0 0 12.3979 2.2879 -2.3689 H 0 0 0 0 0 0 0 0 0 0 0 0 12.7789 3.5511 -1.1713 H 0 0 0 0 0 0 0 0 0 0 0 0 14.1133 2.9263 -2.1834 H 0 0 0 0 0 0 0 0 0 0 0 0 12.9366 1.9183 0.3598 H 0 0 0 0 0 0 0 0 0 0 0 0 14.5707 1.7799 -0.3194 H 0 0 0 0 0 0 0 0 0 0 0 0 13.7578 -0.4720 -0.1651 H 0 0 0 0 0 0 0 0 0 0 0 0 13.9790 0.6917 -2.9201 H 0 0 0 0 0 0 0 0 0 0 0 0 13.9640 -1.0773 -2.5516 H 0 0 0 0 0 0 0 0 0 0 0 0 15.2521 -0.0326 -1.8010 H 0 0 0 0 0 0 0 0 0 0 0 0 11.5120 0.3115 -2.1666 H 0 0 0 0 0 0 0 0 0 0 0 0 12.0114 -1.3566 -1.7267 H 0 0 0 0 0 0 0 0 0 0 0 0 9.9754 -0.7754 -0.8443 H 0 0 0 0 0 0 0 0 0 0 0 0 10.8694 1.3781 1.1240 H 0 0 0 0 0 0 0 0 0 0 0 0 9.3445 1.2370 0.1275 H 0 0 0 0 0 0 0 0 0 0 0 0 10.8227 1.7788 -0.6223 H 0 0 0 0 0 0 0 0 0 0 0 0 11.6877 -2.1382 0.2965 H 0 0 0 0 0 0 0 0 0 0 0 0 12.3154 -0.7531 1.1662 H 0 0 0 0 0 0 0 0 0 0 0 0 11.3964 -1.9935 2.7870 H 0 0 0 0 0 0 0 0 0 0 0 0 10.4041 -0.5641 2.6873 H 0 0 0 0 0 0 0 0 0 0 0 0 9.6439 -3.4023 1.7347 H 0 0 0 0 0 0 0 0 0 0 0 0 9.4553 -2.7556 3.3447 H 0 0 0 0 0 0 0 0 0 0 0 0 7.5110 -3.1149 2.4991 H 0 0 0 0 0 0 0 0 0 0 0 0 7.6211 -1.3948 2.7589 H 0 0 0 0 0 0 0 0 0 0 0 0 6.0931 -2.3594 0.9347 H 0 0 0 0 0 0 0 0 0 0 0 0 7.5056 -2.7435 -0.0219 H 0 0 0 0 0 0 0 0 0 0 0 0 6.2561 -0.8460 -0.7650 H 0 0 0 0 0 0 0 0 0 0 0 0 7.9553 -0.4727 -0.5885 H 0 0 0 0 0 0 0 0 0 0 0 0 6.6173 1.3631 0.1170 H 0 0 0 0 0 0 0 0 0 0 0 0 7.5057 0.7843 1.5392 H 0 0 0 0 0 0 0 0 0 0 0 0 5.2256 1.3690 2.0820 H 0 0 0 0 0 0 0 0 0 0 0 0 5.4796 -0.3772 2.3354 H 0 0 0 0 0 0 0 0 0 0 0 0 2.8439 0.1842 2.3623 H 0 0 0 0 0 0 0 0 0 0 0 0 1.8502 -0.2654 -0.4865 H 0 0 0 0 0 0 0 0 0 0 0 0 1.2120 1.7159 1.6407 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.2217 0.7839 1.2351 H 0 0 0 0 0 0 0 0 0 0 0 0 0.8131 1.3856 -1.3101 H 0 0 0 0 0 0 0 0 0 0 0 0 1.2314 2.8241 -0.2960 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9419 3.3604 -1.1683 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0298 1.3162 -2.2503 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.2409 2.4406 1.6036 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.9810 3.5922 -1.2880 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.7388 4.9590 0.7385 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.1953 5.3567 -0.5311 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.5771 5.9445 -1.2394 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.1561 6.9261 -1.3914 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.1626 6.7671 -2.9293 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.8219 5.5664 -2.5170 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.0927 3.8027 -2.7967 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.8265 4.1394 -2.7490 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.7770 1.4854 0.0022 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.2463 3.1906 1.9744 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.0381 2.5697 3.0956 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.9260 4.7972 1.3214 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.9071 4.3450 -0.0757 H 0 0 0 0 0 0 0 0 0 0 0 0 -10.4022 4.7153 0.9074 H 0 0 0 0 0 0 0 0 0 0 0 0 -10.8664 2.9708 0.6127 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.8095 0.7289 1.9866 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.7121 -1.0220 -1.0489 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.5602 -2.4106 -2.0216 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.0631 -0.8123 -1.4079 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.9717 -1.7844 0.6369 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.4262 -3.4009 0.1889 H 0 0 0 0 0 0 0 0 0 0 0 0 -9.5335 -4.5873 -1.6280 H 0 0 0 0 0 0 0 0 0 0 0 0 -11.6698 -4.9043 -2.8158 H 0 0 0 0 0 0 0 0 0 0 0 0 -14.4676 -3.5072 -2.6251 H 0 0 0 0 0 0 0 0 0 0 0 0 -12.9398 -0.9973 -1.6464 H 0 0 0 0 0 0 0 0 0 0 0 0 -10.8064 -0.6919 -0.4649 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.5575 -3.7012 0.0500 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.7616 -4.1895 0.6803 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.9319 -3.5341 2.7526 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.6457 -3.3414 2.4100 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.3521 -0.9773 2.7128 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.5585 -0.4581 3.7019 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.3205 -0.1454 1.2089 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.8256 -0.6086 0.3145 H 0 0 0 0 0 0 0 0 0 0 0 0 0.6396 -2.6036 -1.2565 H 0 0 0 0 0 0 0 0 0 0 0 0 1.0793 -4.6707 -0.7915 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.4356 -4.4949 1.6810 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9448 -5.8995 0.7411 H 0 0 0 0 0 0 0 0 0 0 0 0 0.7721 -5.6747 1.1725 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.3761 -4.5841 -2.3572 H 0 0 0 0 0 0 0 0 0 0 0 0 1.1883 -3.3361 1.3130 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 3 5 1 0 5 6 1 0 6 7 1 0 6 8 1 0 8 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 2 0 16 18 1 0 18 19 1 0 19 20 1 0 20 21 1 0 21 22 1 0 22 23 1 0 22 24 1 0 24 25 1 0 25 26 2 0 25 27 1 0 27 28 1 0 28 29 1 0 28 30 1 0 30 31 1 0 30 32 1 0 32 33 1 0 33 34 1 0 34 35 2 0 34 36 1 0 36 37 1 0 37 38 1 0 37 39 1 0 39 40 1 0 40 41 1 0 40 42 2 0 36 43 1 0 43 44 1 0 44 45 2 0 44 46 1 0 46 47 1 0 47 48 1 0 48 49 1 0 49 50 2 0 50 51 1 0 51 52 2 0 52 53 1 0 52 54 1 0 54 55 2 0 46 56 1 0 56 57 1 0 57 58 2 0 57 59 1 0 59 60 1 0 60 61 1 0 61 62 1 0 61 63 1 0 63 64 1 0 64 65 1 0 65 66 2 0 65 67 1 0 67 68 1 0 68 69 1 0 68 70 1 0 67 71 1 0 71 72 1 0 72 73 2 0 72 19 1 0 33 27 1 0 55 49 1 0 64 59 1 0 1 74 1 0 1 75 1 0 1 76 1 0 2 77 1 0 2 78 1 0 3 79 1 1 4 80 1 0 4 81 1 0 4 82 1 0 5 83 1 0 5 84 1 0 6 85 1 6 7 86 1 0 7 87 1 0 7 88 1 0 8 89 1 0 8 90 1 0 9 91 1 0 9 92 1 0 10 93 1 0 10 94 1 0 11 95 1 0 11 96 1 0 12 97 1 0 12 98 1 0 13 99 1 0 13100 1 0 14101 1 0 14102 1 0 15103 1 0 15104 1 0 18105 1 0 19106 1 6 20107 1 0 20108 1 0 21109 1 0 21110 1 0 22111 1 6 23112 1 0 24113 1 0 27114 1 6 28115 1 1 29116 1 0 30117 1 1 31118 1 0 31119 1 0 31120 1 0 32121 1 0 32122 1 0 36123 1 6 37124 1 1 38125 1 0 39126 1 0 39127 1 0 41128 1 0 41129 1 0 43130 1 0 46131 1 6 47132 1 0 47133 1 0 48134 1 0 48135 1 0 50136 1 0 51137 1 0 53138 1 0 54139 1 0 55140 1 0 56141 1 0 59142 1 1 60143 1 0 60144 1 0 61145 1 1 62146 1 0 63147 1 0 63148 1 0 67149 1 6 68150 1 6 69151 1 0 69152 1 0 69153 1 0 70154 1 0 71155 1 0 M END