RDKit 3D 158158 0 0 0 0 0 0 0 0999 V2000 10.5891 -2.8438 -0.0786 C 0 0 0 0 0 0 0 0 0 0 0 0 9.6756 -2.2565 0.9956 C 0 0 0 0 0 0 0 0 0 0 0 0 9.1817 -0.9406 0.4690 C 0 0 2 0 0 0 0 0 0 0 0 0 10.3856 -0.0284 0.2083 C 0 0 0 0 0 0 0 0 0 0 0 0 8.3026 -0.2144 1.4525 C 0 0 0 0 0 0 0 0 0 0 0 0 7.0620 -0.9814 1.8388 C 0 0 0 0 0 0 0 0 0 0 0 0 6.2053 -1.2891 0.6372 C 0 0 0 0 0 0 0 0 0 0 0 0 5.7269 -0.0828 -0.1065 C 0 0 0 0 0 0 0 0 0 0 0 0 4.9227 0.8802 0.6151 C 0 0 0 0 0 0 0 0 0 0 0 0 3.6571 0.6528 1.2665 C 0 0 0 0 0 0 0 0 0 0 0 0 2.4541 0.2425 0.5202 C 0 0 2 0 0 0 0 0 0 0 0 0 2.5804 -1.0848 -0.1703 C 0 0 0 0 0 0 0 0 0 0 0 0 2.1332 -2.2006 0.7449 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3396 -1.9686 1.9760 O 0 0 0 0 0 0 0 0 0 0 0 0 1.5500 -3.3909 0.3588 N 0 0 0 0 0 0 0 0 0 0 0 0 0.3519 -3.6134 -0.4603 C 0 0 1 0 0 0 0 0 0 0 0 0 0.8454 -4.0066 -1.7923 C 0 0 0 0 0 0 0 0 0 0 0 0 1.7031 -5.2317 -1.8818 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1004 -6.4933 -1.5081 C 0 0 0 0 0 0 0 0 0 0 0 0 1.9746 -7.5878 -1.2035 N 0 0 0 0 0 0 0 0 0 0 0 0 -0.1223 -6.6971 -1.4353 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.5795 -4.5052 0.2449 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0428 -5.2210 1.1856 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.9560 -4.6855 0.0450 N 0 0 0 0 0 0 0 0 0 0 0 0 -2.7338 -4.6588 -1.1611 C 0 0 1 0 0 0 0 0 0 0 0 0 -3.7060 -5.8749 -1.1568 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.5120 -5.8535 -2.4111 C 0 0 2 0 0 0 0 0 0 0 0 0 -5.4708 -7.0532 -2.3697 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.5993 -6.1054 -3.5948 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.4675 -3.4206 -1.4576 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.2128 -2.9409 -2.6523 O 0 0 0 0 0 0 0 0 0 0 0 0 -4.3770 -2.6652 -0.7215 N 0 0 0 0 0 0 0 0 0 0 0 0 -4.2915 -1.8241 0.4235 C 0 0 2 0 0 0 0 0 0 0 0 0 -3.8421 -2.4049 1.7017 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.6095 -3.5126 2.3132 C 0 0 1 0 0 0 0 0 0 0 0 0 -3.8231 -3.8681 3.6026 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.9908 -3.1662 2.7964 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.6192 -1.1347 0.6716 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.6243 -1.8321 0.2916 O 0 0 0 0 0 0 0 0 0 0 0 0 -5.8366 0.0956 1.2320 N 0 0 0 0 0 0 0 0 0 0 0 0 -5.4063 1.4124 0.7257 C 0 0 1 0 0 0 0 0 0 0 0 0 -6.6173 1.9658 0.0024 C 0 0 2 0 0 0 0 0 0 0 0 0 -7.7927 2.1041 0.9706 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.0884 0.9877 -1.0592 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.9351 2.2593 1.8408 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.8042 2.4426 2.7703 O 0 0 0 0 0 0 0 0 0 0 0 0 -3.6837 2.8708 2.0036 N 0 0 0 0 0 0 0 0 0 0 0 0 -2.9479 3.7314 1.1105 C 0 0 1 0 0 0 0 0 0 0 0 0 -3.7895 4.2883 -0.0025 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.8888 5.0853 0.5805 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.7677 5.5857 -0.1699 O 0 0 0 0 0 0 0 0 0 0 0 0 -4.9519 5.2819 1.9449 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.2101 4.8039 1.8476 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.3936 4.7574 3.1285 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.3914 5.8000 1.3547 N 0 0 0 0 0 0 0 0 0 0 0 0 -0.1848 5.7442 0.5572 C 0 0 2 0 0 0 0 0 0 0 0 0 -0.4220 5.8154 -0.9078 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.1558 7.1461 -1.1831 C 0 0 2 0 0 0 0 0 0 0 0 0 -1.4137 7.2393 -2.6622 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.3580 8.3056 -0.6593 C 0 0 0 0 0 0 0 0 0 0 0 0 0.7625 4.7124 1.0219 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0646 4.8854 2.2717 O 0 0 0 0 0 0 0 0 0 0 0 0 1.3581 3.6415 0.3961 N 0 0 0 0 0 0 0 0 0 0 0 0 2.1915 3.5816 -0.7792 C 0 0 1 0 0 0 0 0 0 0 0 0 3.4631 4.3557 -0.7013 C 0 0 2 0 0 0 0 0 0 0 0 0 3.2923 5.8381 -0.4706 C 0 0 0 0 0 0 0 0 0 0 0 0 4.3235 4.1915 -1.9376 C 0 0 0 0 0 0 0 0 0 0 0 0 2.4581 2.1400 -1.1709 C 0 0 0 0 0 0 0 0 0 0 0 0 3.1493 2.0380 -2.2485 O 0 0 0 0 0 0 0 0 0 0 0 0 1.9980 1.1426 -0.4398 O 0 0 0 0 0 0 0 0 0 0 0 0 10.2804 -2.4699 -1.0867 H 0 0 0 0 0 0 0 0 0 0 0 0 11.6502 -2.6003 0.1258 H 0 0 0 0 0 0 0 0 0 0 0 0 10.5028 -3.9462 -0.1119 H 0 0 0 0 0 0 0 0 0 0 0 0 10.2867 -2.0982 1.9095 H 0 0 0 0 0 0 0 0 0 0 0 0 8.8456 -2.9522 1.1358 H 0 0 0 0 0 0 0 0 0 0 0 0 8.7177 -1.0957 -0.5175 H 0 0 0 0 0 0 0 0 0 0 0 0 10.0886 1.0438 0.2103 H 0 0 0 0 0 0 0 0 0 0 0 0 11.1869 -0.1723 0.9570 H 0 0 0 0 0 0 0 0 0 0 0 0 10.8091 -0.2439 -0.8131 H 0 0 0 0 0 0 0 0 0 0 0 0 8.9269 -0.0243 2.3659 H 0 0 0 0 0 0 0 0 0 0 0 0 8.0688 0.7806 1.0329 H 0 0 0 0 0 0 0 0 0 0 0 0 7.3514 -1.9308 2.3125 H 0 0 0 0 0 0 0 0 0 0 0 0 6.5219 -0.3083 2.5628 H 0 0 0 0 0 0 0 0 0 0 0 0 5.4100 -2.0335 0.8773 H 0 0 0 0 0 0 0 0 0 0 0 0 6.8799 -1.8477 -0.0797 H 0 0 0 0 0 0 0 0 0 0 0 0 5.3894 -0.3834 -1.1113 H 0 0 0 0 0 0 0 0 0 0 0 0 6.7277 0.4509 -0.3834 H 0 0 0 0 0 0 0 0 0 0 0 0 4.7862 1.7800 -0.0920 H 0 0 0 0 0 0 0 0 0 0 0 0 5.6115 1.3982 1.3979 H 0 0 0 0 0 0 0 0 0 0 0 0 3.7208 -0.0647 2.1531 H 0 0 0 0 0 0 0 0 0 0 0 0 3.3341 1.6060 1.8396 H 0 0 0 0 0 0 0 0 0 0 0 0 1.6181 0.1073 1.3189 H 0 0 0 0 0 0 0 0 0 0 0 0 1.9580 -1.1192 -1.1067 H 0 0 0 0 0 0 0 0 0 0 0 0 3.5772 -1.3861 -0.4874 H 0 0 0 0 0 0 0 0 0 0 0 0 1.9903 -4.3154 0.6786 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.1316 -2.5825 -0.6202 H 0 0 0 0 0 0 0 0 0 0 0 0 1.4980 -3.1718 -2.2084 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0536 -4.0857 -2.5733 H 0 0 0 0 0 0 0 0 0 0 0 0 2.6731 -5.0736 -1.2999 H 0 0 0 0 0 0 0 0 0 0 0 0 2.1112 -5.3493 -2.9419 H 0 0 0 0 0 0 0 0 0 0 0 0 1.6475 -8.5577 -1.4150 H 0 0 0 0 0 0 0 0 0 0 0 0 2.9150 -7.4729 -0.7870 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.5234 -4.8913 0.9174 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.1062 -4.9374 -2.0557 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.3666 -5.7270 -0.2589 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.0902 -6.7605 -1.0262 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.0877 -4.9291 -2.5561 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.8849 -7.2651 -3.3711 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.3122 -6.7795 -1.6842 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.9287 -7.9135 -1.9600 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.4416 -5.1913 -4.1860 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.6262 -6.4774 -3.2349 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.9910 -6.9306 -4.2529 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.4056 -2.7027 -1.1159 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.6081 -0.9108 0.2685 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.8576 -1.5720 2.5032 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.7571 -2.6730 1.6996 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.6897 -4.4414 1.7524 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.1012 -3.0831 4.3378 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.1899 -4.8248 3.9751 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.7470 -3.8338 3.4021 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.1028 -3.6049 3.8349 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.8068 -3.6743 2.2318 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.1440 -2.0849 2.9483 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.3845 0.1574 2.1437 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.6265 1.2670 -0.0557 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.4673 2.9333 -0.4722 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.7169 3.0080 1.6042 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.7255 2.2540 0.3696 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.9661 1.2230 1.5808 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.4825 1.5913 -1.8993 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.2580 0.3748 -1.4699 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.9307 0.3689 -0.7062 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.1719 2.6901 2.9267 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.1459 3.0909 0.6481 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.2143 3.5357 -0.6566 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.1456 4.9611 -0.6442 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.9856 6.2321 2.3375 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.6996 6.8021 1.6097 H 0 0 0 0 0 0 0 0 0 0 0 0 0.3946 6.7162 0.7504 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9128 4.9901 -1.3890 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5834 6.0636 -1.3790 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.1016 7.0928 -0.6497 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.3487 8.2845 -3.0379 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.6824 6.6299 -3.2538 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.4141 6.8473 -2.9482 H 0 0 0 0 0 0 0 0 0 0 0 0 0.7347 8.1409 -0.6661 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.7763 8.6512 0.2885 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5231 9.1455 -1.3997 H 0 0 0 0 0 0 0 0 0 0 0 0 1.1943 2.6670 0.8400 H 0 0 0 0 0 0 0 0 0 0 0 0 1.5984 4.0190 -1.6235 H 0 0 0 0 0 0 0 0 0 0 0 0 4.0522 3.9875 0.1612 H 0 0 0 0 0 0 0 0 0 0 0 0 4.3460 6.2198 -0.2754 H 0 0 0 0 0 0 0 0 0 0 0 0 2.9417 6.2732 -1.4265 H 0 0 0 0 0 0 0 0 0 0 0 0 2.6785 6.0799 0.4077 H 0 0 0 0 0 0 0 0 0 0 0 0 4.9861 5.1105 -1.9701 H 0 0 0 0 0 0 0 0 0 0 0 0 5.0133 3.3560 -1.8453 H 0 0 0 0 0 0 0 0 0 0 0 0 3.7355 4.1763 -2.8760 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 7 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 2 0 13 15 1 0 15 16 1 0 16 17 1 0 17 18 1 0 18 19 1 0 19 20 1 0 19 21 2 0 16 22 1 0 22 23 2 0 22 24 1 0 24 25 1 0 25 26 1 0 26 27 1 0 27 28 1 0 27 29 1 0 25 30 1 0 30 31 2 0 30 32 1 0 32 33 1 0 33 34 1 0 34 35 1 0 35 36 1 0 35 37 1 0 33 38 1 0 38 39 2 0 38 40 1 0 40 41 1 0 41 42 1 0 42 43 1 0 42 44 1 0 41 45 1 0 45 46 2 0 45 47 1 0 47 48 1 0 48 49 1 0 49 50 1 0 50 51 2 0 50 52 1 0 48 53 1 0 53 54 2 0 53 55 1 0 55 56 1 0 56 57 1 0 57 58 1 0 58 59 1 0 58 60 1 0 56 61 1 0 61 62 2 0 61 63 1 0 63 64 1 0 64 65 1 0 65 66 1 0 65 67 1 0 64 68 1 0 68 69 2 0 68 70 1 0 70 11 1 0 1 71 1 0 1 72 1 0 1 73 1 0 2 74 1 0 2 75 1 0 3 76 1 6 4 77 1 0 4 78 1 0 4 79 1 0 5 80 1 0 5 81 1 0 6 82 1 0 6 83 1 0 7 84 1 0 7 85 1 0 8 86 1 0 8 87 1 0 9 88 1 0 9 89 1 0 10 90 1 0 10 91 1 0 11 92 1 1 12 93 1 0 12 94 1 0 15 95 1 0 16 96 1 6 17 97 1 0 17 98 1 0 18 99 1 0 18100 1 0 20101 1 0 20102 1 0 24103 1 0 25104 1 6 26105 1 0 26106 1 0 27107 1 6 28108 1 0 28109 1 0 28110 1 0 29111 1 0 29112 1 0 29113 1 0 32114 1 0 33115 1 6 34116 1 0 34117 1 0 35118 1 6 36119 1 0 36120 1 0 36121 1 0 37122 1 0 37123 1 0 37124 1 0 40125 1 0 41126 1 6 42127 1 6 43128 1 0 43129 1 0 43130 1 0 44131 1 0 44132 1 0 44133 1 0 47134 1 0 48135 1 6 49136 1 0 49137 1 0 52138 1 0 55139 1 0 56140 1 1 57141 1 0 57142 1 0 58143 1 1 59144 1 0 59145 1 0 59146 1 0 60147 1 0 60148 1 0 60149 1 0 63150 1 0 64151 1 6 65152 1 1 66153 1 0 66154 1 0 66155 1 0 67156 1 0 67157 1 0 67158 1 0 M END