RDKit 3D 122129 0 0 0 0 0 0 0 0999 V2000 2.5368 1.6050 1.1273 C 0 0 0 0 0 0 0 0 0 0 0 0 1.9182 0.6256 0.1804 C 0 0 0 0 0 0 0 0 0 0 0 0 2.5807 0.8295 -1.1719 C 0 0 0 0 0 0 0 0 0 0 0 0 2.1274 -0.8002 0.5457 C 0 0 1 0 0 0 0 0 0 0 0 0 3.4163 -1.1434 0.9384 O 0 0 0 0 0 0 0 0 0 0 0 0 3.8960 -2.1502 0.1133 C 0 0 2 0 0 0 0 0 0 0 0 0 3.8901 -3.3847 0.8406 O 0 0 0 0 0 0 0 0 0 0 0 0 3.7635 -4.4045 -0.0740 C 0 0 0 0 0 0 0 0 0 0 0 0 4.3603 -4.0585 -1.3841 C 0 0 2 0 0 0 0 0 0 0 0 0 4.8795 -5.2669 -1.9194 O 0 0 0 0 0 0 0 0 0 0 0 0 5.5394 -3.1184 -1.3530 C 0 0 2 0 0 0 0 0 0 0 0 0 6.6222 -3.8127 -0.8358 O 0 0 0 0 0 0 0 0 0 0 0 0 5.2590 -1.9373 -0.4336 C 0 0 1 0 0 0 0 0 0 0 0 0 5.4062 -0.7328 -1.0303 O 0 0 0 0 0 0 0 0 0 0 0 0 6.4354 0.0458 -0.5091 C 0 0 2 0 0 0 0 0 0 0 0 0 6.1026 1.3257 -0.1918 O 0 0 0 0 0 0 0 0 0 0 0 0 7.1050 2.1557 0.2157 C 0 0 1 0 0 0 0 0 0 0 0 0 7.6381 1.6747 1.5553 C 0 0 0 0 0 0 0 0 0 0 0 0 6.6114 1.6821 2.5186 O 0 0 0 0 0 0 0 0 0 0 0 0 8.2777 2.2729 -0.7268 C 0 0 1 0 0 0 0 0 0 0 0 0 9.3921 2.7935 -0.0284 O 0 0 0 0 0 0 0 0 0 0 0 0 8.6702 0.9142 -1.2029 C 0 0 1 0 0 0 0 0 0 0 0 0 9.4080 0.1841 -0.2911 O 0 0 0 0 0 0 0 0 0 0 0 0 7.4863 0.0856 -1.6339 C 0 0 2 0 0 0 0 0 0 0 0 0 6.9304 0.7103 -2.7474 O 0 0 0 0 0 0 0 0 0 0 0 0 1.1964 -1.3198 1.6285 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.2460 -1.0736 1.3442 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.4803 0.4084 1.0145 C 0 0 2 0 0 0 0 0 0 0 0 0 -0.2226 1.1180 2.3479 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.8843 0.6595 0.5767 C 0 0 2 0 0 0 0 0 0 0 0 0 -2.8499 -0.4341 0.9247 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.2868 0.1285 0.9132 C 0 0 2 0 0 0 0 0 0 0 0 0 -5.0822 -0.9607 1.2231 O 0 0 0 0 0 0 0 0 0 0 0 0 -6.4282 -0.8025 0.9815 C 0 0 1 0 0 0 0 0 0 0 0 0 -7.1091 -2.0649 1.4767 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.8311 -2.2146 2.9534 C 0 0 0 0 0 0 0 0 0 0 0 0 -8.6100 -2.0118 1.2880 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.5854 -3.1953 0.8161 O 0 0 0 0 0 0 0 0 0 0 0 0 -7.0485 0.3665 1.6554 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.8667 0.9817 0.5140 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.0235 0.5848 -0.6788 C 0 0 2 0 0 0 0 0 0 0 0 0 -7.7694 0.6673 -1.9763 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.6923 -0.7309 -0.3814 O 0 0 0 0 0 0 0 0 0 0 0 0 -5.7782 1.4477 -0.6585 C 0 0 2 0 0 0 0 0 0 0 0 0 -5.5138 1.9458 -2.0791 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.9910 2.0275 -2.2209 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.4889 1.6501 -0.8908 C 0 0 1 0 0 0 0 0 0 0 0 0 -3.5902 2.8640 0.0066 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.5337 0.6338 -0.4384 C 0 0 1 0 0 0 0 0 0 0 0 0 -2.0880 1.0327 -0.8687 C 0 0 2 0 0 0 0 0 0 0 0 0 -2.0428 -0.0953 -1.8355 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.1529 2.1135 -1.3594 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0753 2.2431 -0.4474 C 0 0 0 0 0 0 0 0 0 0 0 0 0.4517 0.8485 -0.0582 C 0 0 1 0 0 0 0 0 0 0 0 0 2.4596 1.3229 2.1941 H 0 0 0 0 0 0 0 0 0 0 0 0 2.1313 2.6075 0.8987 H 0 0 0 0 0 0 0 0 0 0 0 0 3.6226 1.6544 0.9043 H 0 0 0 0 0 0 0 0 0 0 0 0 1.9658 1.4570 -1.8632 H 0 0 0 0 0 0 0 0 0 0 0 0 2.8066 -0.1597 -1.6456 H 0 0 0 0 0 0 0 0 0 0 0 0 3.5022 1.4126 -1.0040 H 0 0 0 0 0 0 0 0 0 0 0 0 1.8418 -1.4181 -0.3555 H 0 0 0 0 0 0 0 0 0 0 0 0 3.1625 -2.3789 -0.7119 H 0 0 0 0 0 0 0 0 0 0 0 0 4.1571 -5.3768 0.3415 H 0 0 0 0 0 0 0 0 0 0 0 0 2.6641 -4.6204 -0.2551 H 0 0 0 0 0 0 0 0 0 0 0 0 3.5959 -3.7504 -2.1356 H 0 0 0 0 0 0 0 0 0 0 0 0 5.2356 -5.7905 -1.1543 H 0 0 0 0 0 0 0 0 0 0 0 0 5.7760 -2.8209 -2.3729 H 0 0 0 0 0 0 0 0 0 0 0 0 6.3979 -4.3155 -0.0077 H 0 0 0 0 0 0 0 0 0 0 0 0 6.0014 -2.0154 0.4154 H 0 0 0 0 0 0 0 0 0 0 0 0 6.9494 -0.4777 0.3196 H 0 0 0 0 0 0 0 0 0 0 0 0 6.6687 3.1806 0.4004 H 0 0 0 0 0 0 0 0 0 0 0 0 8.4379 2.3728 1.9101 H 0 0 0 0 0 0 0 0 0 0 0 0 8.0676 0.6787 1.5426 H 0 0 0 0 0 0 0 0 0 0 0 0 7.0032 1.4595 3.3934 H 0 0 0 0 0 0 0 0 0 0 0 0 8.0514 2.9554 -1.5669 H 0 0 0 0 0 0 0 0 0 0 0 0 9.8251 3.5224 -0.5414 H 0 0 0 0 0 0 0 0 0 0 0 0 9.2904 1.0532 -2.1160 H 0 0 0 0 0 0 0 0 0 0 0 0 10.3540 0.2833 -0.4957 H 0 0 0 0 0 0 0 0 0 0 0 0 7.8382 -0.9153 -1.9075 H 0 0 0 0 0 0 0 0 0 0 0 0 6.9943 0.1752 -3.5652 H 0 0 0 0 0 0 0 0 0 0 0 0 1.3305 -2.4443 1.5916 H 0 0 0 0 0 0 0 0 0 0 0 0 1.5529 -1.0326 2.6221 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5940 -1.7401 0.5671 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.7870 -1.3069 2.3089 H 0 0 0 0 0 0 0 0 0 0 0 0 0.3196 0.5129 3.0722 H 0 0 0 0 0 0 0 0 0 0 0 0 0.1993 2.1176 2.2309 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.2401 1.2853 2.8162 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.2567 1.5521 1.1687 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.7265 -0.8174 1.9596 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.8627 -1.2851 0.2500 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.3299 0.8209 1.7469 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.5443 -3.2546 3.2142 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.7613 -2.0031 3.5572 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.0605 -1.4904 3.3065 H 0 0 0 0 0 0 0 0 0 0 0 0 -9.0265 -1.3495 2.0489 H 0 0 0 0 0 0 0 0 0 0 0 0 -9.0059 -3.0402 1.4736 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.8713 -1.7775 0.2477 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.7713 -3.4840 1.2982 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.3269 1.1509 1.9593 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.7319 0.1516 2.4766 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.8909 0.6051 0.4801 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.8224 2.0938 0.5717 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.8641 0.4600 -1.8108 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.4405 -0.0957 -2.7135 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.7409 1.6997 -2.3961 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.8863 2.3227 -0.0235 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.0152 2.8869 -2.2914 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.8230 1.1463 -2.8148 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.7785 3.1245 -2.3934 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.6131 1.5086 -3.0876 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.6172 3.3295 0.2415 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.0972 2.6776 0.9579 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.1873 3.6919 -0.4833 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.6159 -0.2293 -1.1293 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.0221 -0.2958 -2.3636 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.3597 0.1088 -2.7162 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.7397 -1.0670 -1.4340 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.7088 1.8461 -2.3659 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.6449 3.0854 -1.5280 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.2774 2.8593 0.4057 H 0 0 0 0 0 0 0 0 0 0 0 0 0.8237 2.8284 -0.9673 H 0 0 0 0 0 0 0 0 0 0 0 0 0.2351 0.1874 -0.9480 H 0 0 0 0 0 0 0 0 0 0 0 0 36 35 1 0 35 37 1 0 35 38 1 0 34 35 1 1 34 39 1 0 39 40 1 0 40 41 1 0 41 42 1 6 41 43 1 0 41 44 1 0 44 45 1 0 45 46 1 0 46 47 1 0 47 48 1 1 47 49 1 0 49 32 1 0 32 31 1 0 31 30 1 0 30 28 1 0 28 29 1 1 28 27 1 0 27 26 1 0 26 4 1 0 4 5 1 0 5 6 1 0 6 7 1 0 7 8 1 0 8 9 1 0 9 10 1 0 9 11 1 0 11 12 1 0 11 13 1 0 13 14 1 0 14 15 1 0 15 16 1 0 16 17 1 0 17 18 1 0 18 19 1 0 17 20 1 0 20 21 1 0 20 22 1 0 22 23 1 0 22 24 1 0 24 25 1 0 4 2 1 0 2 1 1 0 2 3 1 0 2 54 1 0 54 53 1 0 53 52 1 0 52 50 1 0 50 51 1 6 32 33 1 0 43 34 1 0 49 44 1 0 50 30 1 0 33 34 1 0 50 47 1 0 54 28 1 0 13 6 1 0 24 15 1 0 36 92 1 0 36 93 1 0 36 94 1 0 37 95 1 0 37 96 1 0 37 97 1 0 38 98 1 0 39 99 1 0 39100 1 0 40101 1 0 40102 1 0 42103 1 0 42104 1 0 42105 1 0 44106 1 1 45107 1 0 45108 1 0 46109 1 0 46110 1 0 48111 1 0 48112 1 0 48113 1 0 49114 1 6 32 91 1 1 31 89 1 0 31 90 1 0 30 88 1 1 29 85 1 0 29 86 1 0 29 87 1 0 27 83 1 0 27 84 1 0 26 81 1 0 26 82 1 0 4 61 1 6 6 62 1 6 8 63 1 0 8 64 1 0 9 65 1 6 10 66 1 0 11 67 1 6 12 68 1 0 13 69 1 1 15 70 1 1 17 71 1 1 18 72 1 0 18 73 1 0 19 74 1 0 20 75 1 6 21 76 1 0 22 77 1 6 23 78 1 0 24 79 1 6 25 80 1 0 1 55 1 0 1 56 1 0 1 57 1 0 3 58 1 0 3 59 1 0 3 60 1 0 54122 1 6 53120 1 0 53121 1 0 52118 1 0 52119 1 0 51115 1 0 51116 1 0 51117 1 0 M END