RDKit 3D 155155 0 0 0 0 0 0 0 0999 V2000 1.1064 -3.5438 4.5534 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2043 -2.0757 4.2604 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0233 -1.6635 2.9882 C 0 0 0 0 0 0 0 0 0 0 0 0 0.7523 -2.6157 1.9635 N 0 0 0 0 0 0 0 0 0 0 0 0 0.6499 -2.4114 0.5850 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.3710 -2.9977 0.0409 O 0 0 0 0 0 0 0 0 0 0 0 0 1.4863 -1.6597 -0.3385 C 0 0 1 0 0 0 0 0 0 0 0 0 2.9179 -1.7325 -0.0102 N 0 0 0 0 0 0 0 0 0 0 0 0 3.6189 -0.5229 0.1902 C 0 0 0 0 0 0 0 0 0 0 0 0 3.0252 0.6073 0.1070 O 0 0 0 0 0 0 0 0 0 0 0 0 5.0824 -0.4553 0.5072 C 0 0 0 0 0 0 0 0 0 0 0 0 5.4660 0.9346 0.8755 C 0 0 0 0 0 0 0 0 0 0 0 0 6.8916 1.1909 1.1669 C 0 0 0 0 0 0 0 0 0 0 0 0 7.8364 0.9300 0.0210 C 0 0 0 0 0 0 0 0 0 0 0 0 9.2218 1.3309 0.5455 C 0 0 0 0 0 0 0 0 0 0 0 0 10.2754 1.1862 -0.4547 C 0 0 0 0 0 0 0 0 0 0 0 0 11.3158 0.4225 -0.2710 C 0 0 0 0 0 0 0 0 0 0 0 0 11.5997 -0.3884 0.9114 C 0 0 0 0 0 0 0 0 0 0 0 0 12.8671 0.0609 1.5720 C 0 0 0 0 0 0 0 0 0 0 0 0 14.0987 0.0091 0.7238 C 0 0 0 0 0 0 0 0 0 0 0 0 14.4305 -1.3609 0.2252 C 0 0 0 0 0 0 0 0 0 0 0 0 15.6927 -1.3645 -0.5922 C 0 0 0 0 0 0 0 0 0 0 0 0 15.6466 -0.5386 -1.8220 C 0 0 0 0 0 0 0 0 0 0 0 0 1.3239 -2.1938 -1.7842 C 0 0 2 0 0 0 0 0 0 0 0 0 2.4034 -3.0781 -2.0321 O 0 0 0 0 0 0 0 0 0 0 0 0 1.3403 -1.0663 -2.7631 C 0 0 0 0 0 0 0 0 0 0 0 0 0.3614 -0.0395 -2.5618 N 0 0 0 0 0 0 0 0 0 0 0 0 -0.9625 0.0233 -3.0474 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.2849 1.0541 -3.6956 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.0057 -0.9859 -2.8773 C 0 0 2 0 0 0 0 0 0 0 0 0 -2.1408 -1.9709 -3.9506 C 0 0 1 0 0 0 0 0 0 0 0 0 -2.7392 -3.1459 -3.4309 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.9329 -1.6499 -5.1780 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.3397 -1.5200 -4.9658 N 0 0 0 0 0 0 0 0 0 0 0 0 -3.2366 -0.5648 -2.3066 N 0 0 0 0 0 0 0 0 0 0 0 0 -3.9738 0.6000 -2.1791 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.7443 1.3489 -1.1425 O 0 0 0 0 0 0 0 0 0 0 0 0 -5.0304 1.2199 -2.9924 C 0 0 2 0 0 0 0 0 0 0 0 0 -4.8781 2.6913 -3.1712 C 0 0 2 0 0 0 0 0 0 0 0 0 -3.5850 3.0272 -3.6377 O 0 0 0 0 0 0 0 0 0 0 0 0 -5.3822 3.6267 -2.1491 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.5949 3.7939 -0.9671 N 0 0 0 0 0 0 0 0 0 0 0 0 -6.3639 0.8215 -2.4789 N 0 0 0 0 0 0 0 0 0 0 0 0 -6.7453 -0.4378 -2.0056 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.6778 -0.9367 -2.8732 O 0 0 0 0 0 0 0 0 0 0 0 0 -6.5725 -1.4059 -1.0131 C 0 0 2 0 0 0 0 0 0 0 0 0 -8.0017 -2.1314 -0.9151 C 0 0 0 0 0 0 0 0 0 0 0 0 -8.9265 -1.0253 -0.4993 C 0 0 0 0 0 0 0 0 0 0 0 0 -10.3620 -1.4889 -0.3460 C 0 0 0 0 0 0 0 0 0 0 0 0 -11.1657 -0.3154 0.0780 N 0 0 0 0 0 0 0 0 0 0 0 0 -12.1344 -0.5244 0.9183 C 0 0 0 0 0 0 0 0 0 0 0 0 -12.9229 0.5638 1.3494 N 0 0 0 0 0 0 0 0 0 0 0 0 -12.4469 -1.8197 1.4206 N 0 0 0 0 0 0 0 0 0 0 0 0 -6.1092 -1.4761 0.2889 N 0 0 0 0 0 0 0 0 0 0 0 0 -5.6966 -0.9091 1.4504 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.6852 -0.7553 2.3333 O 0 0 0 0 0 0 0 0 0 0 0 0 -4.4415 -0.3969 2.0702 C 0 0 2 0 0 0 0 0 0 0 0 0 -4.6262 0.9041 2.7801 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.0435 2.0888 2.0166 C 0 0 2 0 0 0 0 0 0 0 0 0 -5.1613 3.2958 2.9829 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.3536 1.9589 1.3299 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.2843 -0.4347 1.2800 N 0 0 0 0 0 0 0 0 0 0 0 0 -2.0277 0.1364 1.2639 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.3690 0.1100 0.1269 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.2016 0.8100 2.2910 C 0 0 2 0 0 0 0 0 0 0 0 0 -1.3715 2.3323 2.2431 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.9970 2.9129 0.9215 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.2423 4.3576 0.9734 N 0 0 0 0 0 0 0 0 0 0 0 0 0.2232 0.5863 2.0310 N 0 0 0 0 0 0 0 0 0 0 0 0 1.1212 -0.2195 2.7648 C 0 0 0 0 0 0 0 0 0 0 0 0 2.1613 0.3314 3.3181 O 0 0 0 0 0 0 0 0 0 0 0 0 1.9183 -4.1013 4.0726 H 0 0 0 0 0 0 0 0 0 0 0 0 0.1052 -3.9226 4.2300 H 0 0 0 0 0 0 0 0 0 0 0 0 1.1009 -3.7031 5.6699 H 0 0 0 0 0 0 0 0 0 0 0 0 1.4149 -1.3924 5.0383 H 0 0 0 0 0 0 0 0 0 0 0 0 0.6064 -3.6234 2.2821 H 0 0 0 0 0 0 0 0 0 0 0 0 1.2132 -0.5987 -0.3437 H 0 0 0 0 0 0 0 0 0 0 0 0 3.3343 -2.6698 0.0574 H 0 0 0 0 0 0 0 0 0 0 0 0 5.6785 -0.7338 -0.4117 H 0 0 0 0 0 0 0 0 0 0 0 0 5.2881 -1.2013 1.3010 H 0 0 0 0 0 0 0 0 0 0 0 0 4.8252 1.2189 1.7569 H 0 0 0 0 0 0 0 0 0 0 0 0 5.0744 1.6038 0.0581 H 0 0 0 0 0 0 0 0 0 0 0 0 6.9955 2.2660 1.4253 H 0 0 0 0 0 0 0 0 0 0 0 0 7.2063 0.5932 2.0466 H 0 0 0 0 0 0 0 0 0 0 0 0 7.5320 1.5852 -0.8232 H 0 0 0 0 0 0 0 0 0 0 0 0 7.9125 -0.1067 -0.2994 H 0 0 0 0 0 0 0 0 0 0 0 0 9.1004 2.4479 0.7406 H 0 0 0 0 0 0 0 0 0 0 0 0 9.4026 0.8935 1.5293 H 0 0 0 0 0 0 0 0 0 0 0 0 10.1399 1.7667 -1.3826 H 0 0 0 0 0 0 0 0 0 0 0 0 12.0445 0.3893 -1.0902 H 0 0 0 0 0 0 0 0 0 0 0 0 10.7677 -0.4975 1.6136 H 0 0 0 0 0 0 0 0 0 0 0 0 11.8064 -1.4417 0.5272 H 0 0 0 0 0 0 0 0 0 0 0 0 12.7133 1.1225 1.9143 H 0 0 0 0 0 0 0 0 0 0 0 0 13.0551 -0.5086 2.5320 H 0 0 0 0 0 0 0 0 0 0 0 0 14.9797 0.3013 1.3879 H 0 0 0 0 0 0 0 0 0 0 0 0 14.1083 0.7663 -0.0699 H 0 0 0 0 0 0 0 0 0 0 0 0 13.5723 -1.7567 -0.3714 H 0 0 0 0 0 0 0 0 0 0 0 0 14.6129 -2.0353 1.1101 H 0 0 0 0 0 0 0 0 0 0 0 0 16.5316 -1.0765 0.0905 H 0 0 0 0 0 0 0 0 0 0 0 0 15.9347 -2.4300 -0.8754 H 0 0 0 0 0 0 0 0 0 0 0 0 15.3202 -1.1877 -2.6930 H 0 0 0 0 0 0 0 0 0 0 0 0 14.9257 0.2720 -1.7687 H 0 0 0 0 0 0 0 0 0 0 0 0 16.6721 -0.1613 -2.0627 H 0 0 0 0 0 0 0 0 0 0 0 0 0.4269 -2.8174 -1.7804 H 0 0 0 0 0 0 0 0 0 0 0 0 2.3101 -3.9064 -1.4974 H 0 0 0 0 0 0 0 0 0 0 0 0 1.3881 -1.4268 -3.8205 H 0 0 0 0 0 0 0 0 0 0 0 0 2.3813 -0.6024 -2.6368 H 0 0 0 0 0 0 0 0 0 0 0 0 0.7371 0.7938 -1.9642 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.5595 -1.6719 -1.9933 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.1164 -2.3885 -4.2635 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.6984 -3.1130 -2.4427 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.7984 -2.5254 -5.8746 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.5323 -0.7186 -5.6490 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.8447 -0.9467 -5.6428 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.6715 -1.5470 -3.9995 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.7143 -1.4489 -1.8061 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.8980 0.8463 -4.0709 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.5021 2.9945 -4.1270 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.3866 3.9853 -3.4999 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.4500 3.3921 -1.9238 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.4342 4.6432 -2.6499 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.6829 4.2490 -1.2686 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.1353 4.4712 -0.3516 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.0313 1.6192 -2.5234 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.0208 -2.2924 -1.5602 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.2280 -2.5403 -1.9071 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.9095 -2.8908 -0.1338 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.5759 -0.5992 0.4733 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.9401 -0.1895 -1.2167 H 0 0 0 0 0 0 0 0 0 0 0 0 -10.4317 -2.2997 0.3714 H 0 0 0 0 0 0 0 0 0 0 0 0 -10.7772 -1.7870 -1.3252 H 0 0 0 0 0 0 0 0 0 0 0 0 -13.3153 0.6289 2.3212 H 0 0 0 0 0 0 0 0 0 0 0 0 -13.1516 1.3601 0.7123 H 0 0 0 0 0 0 0 0 0 0 0 0 -12.6071 -2.0186 2.4405 H 0 0 0 0 0 0 0 0 0 0 0 0 -12.5326 -2.6445 0.7791 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.0944 -2.6360 0.4993 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.1831 -1.1086 2.9604 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.4267 0.6659 3.5961 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.7593 1.1602 3.4375 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.2117 2.4062 1.3287 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.2922 3.2925 3.6502 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.1445 4.2004 2.3431 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.0561 3.2107 3.6228 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.1576 1.8236 2.1062 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.3666 1.2364 0.5190 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.5498 2.9578 0.8062 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.4274 -1.1389 0.4336 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.5143 0.4504 3.2700 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5479 2.6827 2.9578 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.2771 2.7115 2.6712 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.5933 2.5102 0.0895 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0913 2.8229 0.6620 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.3536 4.8928 1.1226 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.9523 4.6306 1.6612 H 0 0 0 0 0 0 0 0 0 0 0 0 0.6142 1.0971 1.2040 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 2 3 2 0 3 4 1 0 4 5 1 0 5 6 2 0 5 7 1 0 7 8 1 0 8 9 1 0 9 10 2 0 9 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 17 18 1 0 18 19 1 0 19 20 1 0 20 21 1 0 21 22 1 0 22 23 1 0 7 24 1 0 24 25 1 0 24 26 1 0 26 27 1 0 27 28 1 0 28 29 2 0 28 30 1 0 30 31 1 0 31 32 1 0 31 33 1 0 33 34 1 0 30 35 1 0 35 36 1 0 36 37 2 0 36 38 1 0 38 39 1 0 39 40 1 0 39 41 1 0 41 42 1 0 38 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 1 0 50 51 2 3 51 52 1 0 51 53 1 0 46 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 1 0 59 61 1 0 57 62 1 0 62 63 1 0 63 64 2 0 63 65 1 0 65 66 1 0 66 67 1 0 67 68 1 0 65 69 1 0 69 70 1 0 70 71 2 0 70 3 1 0 1 72 1 0 1 73 1 0 1 74 1 0 2 75 1 0 4 76 1 0 7 77 1 6 8 78 1 0 11 79 1 0 11 80 1 0 12 81 1 0 12 82 1 0 13 83 1 0 13 84 1 0 14 85 1 0 14 86 1 0 15 87 1 0 15 88 1 0 16 89 1 0 17 90 1 0 18 91 1 0 18 92 1 0 19 93 1 0 19 94 1 0 20 95 1 0 20 96 1 0 21 97 1 0 21 98 1 0 22 99 1 0 22100 1 0 23101 1 0 23102 1 0 23103 1 0 24104 1 1 25105 1 0 26106 1 0 26107 1 0 27108 1 0 30109 1 1 31110 1 6 32111 1 0 33112 1 0 33113 1 0 34114 1 0 34115 1 0 35116 1 0 38117 1 6 39118 1 6 40119 1 0 41120 1 0 41121 1 0 42122 1 0 42123 1 0 43124 1 0 46125 1 6 47126 1 0 47127 1 0 48128 1 0 48129 1 0 49130 1 0 49131 1 0 52132 1 0 52133 1 0 53134 1 0 53135 1 0 54136 1 0 57137 1 1 58138 1 0 58139 1 0 59140 1 6 60141 1 0 60142 1 0 60143 1 0 61144 1 0 61145 1 0 61146 1 0 62147 1 0 65148 1 1 66149 1 0 66150 1 0 67151 1 0 67152 1 0 68153 1 0 68154 1 0 69155 1 0 M END