RDKit 3D 165168 0 0 0 0 0 0 0 0999 V2000 -2.8591 -5.3451 -1.4831 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.2857 -5.6745 -0.1173 C 0 0 1 0 0 0 0 0 0 0 0 0 -0.8144 -5.7891 -0.0973 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.9340 -4.8786 0.9507 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.8162 -3.3499 0.7833 C 0 0 2 0 0 0 0 0 0 0 0 0 -1.4293 -2.9810 0.7844 N 0 0 0 0 0 0 0 0 0 0 0 0 -0.5929 -2.3158 1.6692 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0259 -3.1082 2.5501 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.2128 -0.9072 1.8640 C 0 0 1 0 0 0 0 0 0 0 0 0 0.6646 -0.3995 0.8008 N 0 0 0 0 0 0 0 0 0 0 0 0 2.0546 -0.6185 0.8158 C 0 0 0 0 0 0 0 0 0 0 0 0 2.4818 -1.2952 1.8314 O 0 0 0 0 0 0 0 0 0 0 0 0 3.0474 -0.1864 -0.1634 C 0 0 1 0 0 0 0 0 0 0 0 0 4.3205 -0.7898 0.1494 N 0 0 0 0 0 0 0 0 0 0 0 0 5.5729 -0.1747 0.1156 C 0 0 0 0 0 0 0 0 0 0 0 0 5.6745 1.0290 -0.2165 O 0 0 0 0 0 0 0 0 0 0 0 0 6.7732 -0.9530 0.4713 C 0 0 2 0 0 0 0 0 0 0 0 0 6.5726 -1.4229 1.9149 C 0 0 0 0 0 0 0 0 0 0 0 0 7.9985 -0.2171 0.3315 N 0 0 0 0 0 0 0 0 0 0 0 0 9.1087 -0.7208 -0.3814 C 0 0 0 0 0 0 0 0 0 0 0 0 8.9292 -1.8895 -0.8847 O 0 0 0 0 0 0 0 0 0 0 0 0 10.4022 -0.0836 -0.6023 C 0 0 2 0 0 0 0 0 0 0 0 0 10.4068 1.1111 -1.4944 C 0 0 0 0 0 0 0 0 0 0 0 0 9.6138 2.2865 -1.0980 C 0 0 0 0 0 0 0 0 0 0 0 0 10.0164 2.9576 0.1954 C 0 0 0 0 0 0 0 0 0 0 0 0 11.3722 3.5026 0.1801 C 0 0 0 0 0 0 0 0 0 0 0 0 11.6479 4.7765 -0.2809 C 0 0 0 0 0 0 0 0 0 0 0 0 12.9325 5.2630 -0.2953 C 0 0 0 0 0 0 0 0 0 0 0 0 13.9998 4.5131 0.1463 C 0 0 0 0 0 0 0 0 0 0 0 0 15.2870 5.0190 0.1230 O 0 0 0 0 0 0 0 0 0 0 0 0 13.7477 3.2625 0.6040 C 0 0 0 0 0 0 0 0 0 0 0 0 12.4346 2.7657 0.6182 C 0 0 0 0 0 0 0 0 0 0 0 0 11.2726 -1.0692 -1.2899 N 0 0 0 0 0 0 0 0 0 0 0 0 12.5692 -1.3670 -0.8031 C 0 0 0 0 0 0 0 0 0 0 0 0 12.9703 -0.7678 0.2329 O 0 0 0 0 0 0 0 0 0 0 0 0 13.4693 -2.3468 -1.4600 C 0 0 2 0 0 0 0 0 0 0 0 0 12.8291 -3.0686 -2.4528 O 0 0 0 0 0 0 0 0 0 0 0 0 14.1240 -3.1881 -0.4035 C 0 0 0 0 0 0 0 0 0 0 0 0 13.1958 -3.9810 0.2331 O 0 0 0 0 0 0 0 0 0 0 0 0 2.6025 -0.6042 -1.5608 C 0 0 2 0 0 0 0 0 0 0 0 0 2.4476 -2.1005 -1.6694 C 0 0 0 0 0 0 0 0 0 0 0 0 3.6521 -0.1745 -2.5626 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.2857 0.0479 2.2564 C 0 0 1 0 0 0 0 0 0 0 0 0 -0.7759 1.4988 2.1234 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.3979 -0.0709 1.4892 O 0 0 0 0 0 0 0 0 0 0 0 0 -3.1725 0.6678 0.7242 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.2075 0.4079 -0.5405 O 0 0 0 0 0 0 0 0 0 0 0 0 -4.0688 1.8301 1.1334 C 0 0 2 0 0 0 0 0 0 0 0 0 -4.9810 1.3326 2.1724 C 0 0 2 0 0 0 0 0 0 0 0 0 -5.8602 2.4517 2.6761 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.2265 0.8397 3.4053 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.6105 2.3499 -0.0926 N 0 0 0 0 0 0 0 0 0 0 0 0 -5.6680 2.2095 -0.9264 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.5002 1.3419 -1.9135 O 0 0 0 0 0 0 0 0 0 0 0 0 -7.0355 2.7726 -1.0866 C 0 0 2 0 0 0 0 0 0 0 0 0 -7.4219 3.8965 -0.2402 C 0 0 0 0 0 0 0 0 0 0 0 0 -8.7977 4.3743 -0.5741 C 0 0 0 0 0 0 0 0 0 0 0 0 -9.9122 4.1055 0.1623 C 0 0 0 0 0 0 0 0 0 0 0 0 -11.1718 4.5503 -0.2123 C 0 0 0 0 0 0 0 0 0 0 0 0 -11.3345 5.2968 -1.3688 C 0 0 0 0 0 0 0 0 0 0 0 0 -12.5860 5.7349 -1.7373 O 0 0 0 0 0 0 0 0 0 0 0 0 -10.2307 5.5863 -2.1315 C 0 0 0 0 0 0 0 0 0 0 0 0 -10.4315 6.5323 -3.5977 Cl 0 0 0 0 0 0 0 0 0 0 0 0 -8.9953 5.1319 -1.7366 C 0 0 0 0 0 0 0 0 0 0 0 0 -8.0005 1.8116 -1.5438 N 0 0 0 0 0 0 0 0 0 0 0 0 -7.9722 1.6677 -3.0605 C 0 0 0 0 0 0 0 0 0 0 0 0 -8.9520 1.0004 -0.9683 C 0 0 0 0 0 0 0 0 0 0 0 0 -10.1856 1.3507 -1.3546 O 0 0 0 0 0 0 0 0 0 0 0 0 -9.0296 -0.1428 -0.0555 C 0 0 2 0 0 0 0 0 0 0 0 0 -9.8060 0.2664 1.1600 C 0 0 2 0 0 0 0 0 0 0 0 0 -10.3681 -0.9180 1.9121 C 0 0 0 0 0 0 0 0 0 0 0 0 -10.8490 1.1207 0.8517 O 0 0 0 0 0 0 0 0 0 0 0 0 -7.9735 -1.0630 0.0358 N 0 0 0 0 0 0 0 0 0 0 0 0 -7.2257 -1.7177 0.9888 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.4037 -2.1579 2.1518 O 0 0 0 0 0 0 0 0 0 0 0 0 -5.7808 -2.0180 0.5675 C 0 0 2 0 0 0 0 0 0 0 0 0 -5.9039 -3.1021 -0.4434 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.2906 -3.0052 -1.1185 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.5668 -1.5051 -1.3616 C 0 0 1 0 0 0 0 0 0 0 0 0 -8.6006 -1.3930 -2.2402 O 0 0 0 0 0 0 0 0 0 0 0 0 -4.9668 -2.2512 1.7034 N 0 0 0 0 0 0 0 0 0 0 0 0 -3.6723 -2.7756 1.8375 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.0957 -2.7917 2.9931 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.6563 -4.3270 -1.8142 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.5148 -6.0530 -2.2588 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.9653 -5.5039 -1.3865 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.6804 -6.7513 0.0564 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5378 -6.8942 -0.0706 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.2818 -5.4025 -0.9958 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.3267 -5.3939 0.8177 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.4998 -5.1528 1.9415 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.0063 -5.1553 1.0098 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.1761 -3.0735 -0.2409 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.8791 -3.3304 -0.1158 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5272 -0.8710 2.7707 H 0 0 0 0 0 0 0 0 0 0 0 0 0.2349 0.1309 0.0295 H 0 0 0 0 0 0 0 0 0 0 0 0 3.2357 0.9132 -0.2006 H 0 0 0 0 0 0 0 0 0 0 0 0 4.2628 -1.8083 0.4304 H 0 0 0 0 0 0 0 0 0 0 0 0 6.8064 -1.9198 -0.1120 H 0 0 0 0 0 0 0 0 0 0 0 0 5.7142 -2.1422 1.8770 H 0 0 0 0 0 0 0 0 0 0 0 0 6.3739 -0.5933 2.5974 H 0 0 0 0 0 0 0 0 0 0 0 0 7.4720 -2.0148 2.2444 H 0 0 0 0 0 0 0 0 0 0 0 0 8.0672 0.7120 0.7834 H 0 0 0 0 0 0 0 0 0 0 0 0 10.9321 0.1507 0.3310 H 0 0 0 0 0 0 0 0 0 0 0 0 10.0859 0.8247 -2.5308 H 0 0 0 0 0 0 0 0 0 0 0 0 11.4870 1.4025 -1.6178 H 0 0 0 0 0 0 0 0 0 0 0 0 9.6835 3.0314 -1.9427 H 0 0 0 0 0 0 0 0 0 0 0 0 8.5334 2.0595 -1.0431 H 0 0 0 0 0 0 0 0 0 0 0 0 9.9163 2.2455 1.0211 H 0 0 0 0 0 0 0 0 0 0 0 0 9.2417 3.7652 0.3653 H 0 0 0 0 0 0 0 0 0 0 0 0 10.8515 5.3842 -0.6276 H 0 0 0 0 0 0 0 0 0 0 0 0 13.1668 6.2723 -0.6614 H 0 0 0 0 0 0 0 0 0 0 0 0 15.6586 5.5262 0.9165 H 0 0 0 0 0 0 0 0 0 0 0 0 14.5758 2.6540 0.9584 H 0 0 0 0 0 0 0 0 0 0 0 0 12.3662 1.7663 1.0173 H 0 0 0 0 0 0 0 0 0 0 0 0 10.9227 -1.5487 -2.1438 H 0 0 0 0 0 0 0 0 0 0 0 0 14.2622 -1.7466 -2.0172 H 0 0 0 0 0 0 0 0 0 0 0 0 12.5359 -3.9689 -2.1283 H 0 0 0 0 0 0 0 0 0 0 0 0 14.9489 -3.7676 -0.8727 H 0 0 0 0 0 0 0 0 0 0 0 0 14.6049 -2.5392 0.3833 H 0 0 0 0 0 0 0 0 0 0 0 0 13.6765 -4.4126 1.0095 H 0 0 0 0 0 0 0 0 0 0 0 0 1.6276 -0.1216 -1.7536 H 0 0 0 0 0 0 0 0 0 0 0 0 3.0959 -2.6774 -1.0086 H 0 0 0 0 0 0 0 0 0 0 0 0 2.7143 -2.4219 -2.7170 H 0 0 0 0 0 0 0 0 0 0 0 0 1.3612 -2.3845 -1.5765 H 0 0 0 0 0 0 0 0 0 0 0 0 3.2998 -0.4537 -3.5916 H 0 0 0 0 0 0 0 0 0 0 0 0 4.5794 -0.7659 -2.4066 H 0 0 0 0 0 0 0 0 0 0 0 0 3.8422 0.9138 -2.5596 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.4964 -0.0238 3.3802 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0692 1.8682 1.1305 H 0 0 0 0 0 0 0 0 0 0 0 0 0.3320 1.4604 2.1642 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.2017 2.1224 2.9234 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.3125 2.5553 1.5932 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.5918 0.4551 1.8650 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.5597 3.3942 2.1783 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.9356 2.2107 2.5876 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.6789 2.6645 3.7751 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.9417 -0.2084 3.3074 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.9018 0.9369 4.2976 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.3872 1.5298 3.6129 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.8510 3.0940 -0.4688 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.8453 3.3963 -2.1121 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.4659 3.7020 0.8514 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.7424 4.7594 -0.4059 H 0 0 0 0 0 0 0 0 0 0 0 0 -9.7987 3.5397 1.0784 H 0 0 0 0 0 0 0 0 0 0 0 0 -12.0458 4.3338 0.3711 H 0 0 0 0 0 0 0 0 0 0 0 0 -13.4150 5.5456 -1.2078 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.1599 5.3800 -2.3585 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.2918 0.8728 -3.3577 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.5582 2.6100 -3.4988 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.9960 1.6086 -3.4553 H 0 0 0 0 0 0 0 0 0 0 0 0 -9.8405 -0.8316 -0.5807 H 0 0 0 0 0 0 0 0 0 0 0 0 -9.1098 0.7955 1.8610 H 0 0 0 0 0 0 0 0 0 0 0 0 -9.9994 -0.9921 2.9532 H 0 0 0 0 0 0 0 0 0 0 0 0 -11.4652 -0.9111 1.8242 H 0 0 0 0 0 0 0 0 0 0 0 0 -10.0158 -1.8420 1.3708 H 0 0 0 0 0 0 0 0 0 0 0 0 -11.6269 0.9635 1.4477 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.4087 -1.1217 0.0277 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.8382 -4.1241 -0.1008 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.2076 -2.9838 -1.3283 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.2994 -3.5476 -2.0785 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.0943 -3.3713 -0.4874 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.6090 -1.0899 -1.6313 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.2550 -1.3101 -3.1450 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.4138 -1.9813 2.6435 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 2 3 1 0 2 4 1 0 4 5 1 0 5 6 1 0 6 7 1 0 7 8 2 0 7 9 1 0 9 10 1 0 10 11 1 0 11 12 2 0 11 13 1 0 13 14 1 0 14 15 1 0 15 16 2 0 15 17 1 0 17 18 1 0 17 19 1 0 19 20 1 0 20 21 2 0 20 22 1 0 22 23 1 0 23 24 1 0 24 25 1 0 25 26 1 0 26 27 2 0 27 28 1 0 28 29 2 0 29 30 1 0 29 31 1 0 31 32 2 0 22 33 1 0 33 34 1 0 34 35 2 0 34 36 1 0 36 37 1 0 36 38 1 0 38 39 1 0 13 40 1 0 40 41 1 0 40 42 1 0 9 43 1 0 43 44 1 0 43 45 1 0 45 46 1 0 46 47 2 0 46 48 1 0 48 49 1 0 49 50 1 0 49 51 1 0 48 52 1 0 52 53 1 0 53 54 2 0 53 55 1 0 55 56 1 0 56 57 1 0 57 58 2 0 58 59 1 0 59 60 2 0 60 61 1 0 60 62 1 0 62 63 1 0 62 64 2 0 55 65 1 0 65 66 1 0 65 67 1 0 67 68 2 0 67 69 1 0 69 70 1 0 70 71 1 0 70 72 1 0 69 73 1 0 73 74 1 0 74 75 2 0 74 76 1 0 76 77 1 0 77 78 1 0 78 79 1 0 79 80 1 0 76 81 1 0 81 82 1 0 82 83 2 0 82 5 1 0 32 26 1 0 64 57 1 0 79 73 1 0 1 84 1 0 1 85 1 0 1 86 1 0 2 87 1 1 3 88 1 0 3 89 1 0 3 90 1 0 4 91 1 0 4 92 1 0 5 93 1 6 6 94 1 0 9 95 1 1 10 96 1 0 13 97 1 6 14 98 1 0 17 99 1 6 18100 1 0 18101 1 0 18102 1 0 19103 1 0 22104 1 1 23105 1 0 23106 1 0 24107 1 0 24108 1 0 25109 1 0 25110 1 0 27111 1 0 28112 1 0 30113 1 0 31114 1 0 32115 1 0 33116 1 0 36117 1 6 37118 1 0 38119 1 0 38120 1 0 39121 1 0 40122 1 6 41123 1 0 41124 1 0 41125 1 0 42126 1 0 42127 1 0 42128 1 0 43129 1 1 44130 1 0 44131 1 0 44132 1 0 48133 1 1 49134 1 6 50135 1 0 50136 1 0 50137 1 0 51138 1 0 51139 1 0 51140 1 0 52141 1 0 55142 1 6 56143 1 0 56144 1 0 58145 1 0 59146 1 0 61147 1 0 64148 1 0 66149 1 0 66150 1 0 66151 1 0 69152 1 6 70153 1 1 71154 1 0 71155 1 0 71156 1 0 72157 1 0 76158 1 6 77159 1 0 77160 1 0 78161 1 0 78162 1 0 79163 1 6 80164 1 0 81165 1 0 M END