RDKit 3D 166171 0 0 0 0 0 0 0 0999 V2000 5.1331 0.0685 6.2391 C 0 0 0 0 0 0 0 0 0 0 0 0 4.2562 0.5616 5.2169 C 0 0 0 0 0 0 0 0 0 0 0 0 3.6332 -0.3198 4.5286 O 0 0 0 0 0 0 0 0 0 0 0 0 3.9455 1.9167 4.8221 C 0 0 2 0 0 0 0 0 0 0 0 0 2.6425 2.0771 4.3128 N 0 0 0 0 0 0 0 0 0 0 0 0 1.6564 3.0283 4.5511 C 0 0 0 0 0 0 0 0 0 0 0 0 1.7313 4.0083 5.3086 O 0 0 0 0 0 0 0 0 0 0 0 0 0.3406 2.8483 3.8050 C 0 0 2 0 0 0 0 0 0 0 0 0 0.4128 3.8385 2.6446 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.8245 3.0855 4.6728 C 0 0 2 0 0 0 0 0 0 0 0 0 -0.8168 2.2503 5.8101 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.1379 2.8096 3.9426 C 0 0 2 0 0 0 0 0 0 0 0 0 -3.2224 3.0932 4.9856 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.3145 1.3975 3.5971 N 0 0 0 0 0 0 0 0 0 0 0 0 -2.7269 0.9104 2.3704 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.9206 1.8060 1.4562 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.9796 -0.4655 1.9872 C 0 0 1 0 0 0 0 0 0 0 0 0 -3.4365 -0.5091 0.5766 N 0 0 0 0 0 0 0 0 0 0 0 0 -4.6822 0.1363 0.3115 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.3020 0.7442 1.1963 O 0 0 0 0 0 0 0 0 0 0 0 0 -5.1924 0.0323 -1.0704 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.6836 -0.8837 -1.9282 N 0 0 0 0 0 0 0 0 0 0 0 0 -5.1811 -0.9870 -3.1634 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.6891 -2.0715 -4.0938 C 0 0 1 0 0 0 0 0 0 0 0 0 -3.3061 -1.7250 -4.4984 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.6521 -2.6613 -5.3918 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.2947 -2.3389 -5.7973 N 0 0 0 0 0 0 0 0 0 0 0 0 -3.1915 -3.6960 -5.8075 O 0 0 0 0 0 0 0 0 0 0 0 0 -4.7501 -3.3358 -3.4110 N 0 0 0 0 0 0 0 0 0 0 0 0 -5.6292 -4.3108 -3.9871 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.5697 -5.6018 -3.1861 C 0 0 2 0 0 0 0 0 0 0 0 0 -5.9731 -5.3718 -1.8348 N 0 0 0 0 0 0 0 0 0 0 0 0 -4.2250 -6.1888 -3.2673 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.6941 -6.6099 -4.5371 N 0 0 0 0 0 0 0 0 0 0 0 0 -3.5081 -6.3484 -2.2622 O 0 0 0 0 0 0 0 0 0 0 0 0 -6.1747 -0.1653 -3.5145 N 0 0 0 0 0 0 0 0 0 0 0 0 -6.7207 0.7577 -2.7235 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.7750 1.6037 -3.1172 N 0 0 0 0 0 0 0 0 0 0 0 0 -6.2157 0.8725 -1.4341 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.7910 1.8748 -0.4995 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.0513 -1.5494 2.3185 C 0 0 1 0 0 0 0 0 0 0 0 0 -0.7859 -1.6196 1.9080 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.4958 -2.4099 0.8341 C 0 0 2 0 0 0 0 0 0 0 0 0 0.0864 -3.6758 1.2947 O 0 0 0 0 0 0 0 0 0 0 0 0 1.0826 -3.3346 2.1802 C 0 0 1 0 0 0 0 0 0 0 0 0 1.7192 -4.5954 2.7787 C 0 0 0 0 0 0 0 0 0 0 0 0 2.7172 -4.2575 3.6720 O 0 0 0 0 0 0 0 0 0 0 0 0 2.1985 -2.6608 1.4143 C 0 0 1 0 0 0 0 0 0 0 0 0 2.9202 -3.5100 0.6213 O 0 0 0 0 0 0 0 0 0 0 0 0 1.7015 -1.4088 0.6896 C 0 0 2 0 0 0 0 0 0 0 0 0 1.2439 -0.5554 1.6943 O 0 0 0 0 0 0 0 0 0 0 0 0 0.5202 -1.8343 -0.1308 C 0 0 1 0 0 0 0 0 0 0 0 0 0.9228 -3.0839 -0.9780 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0315 -0.9763 -0.9902 O 0 0 0 0 0 0 0 0 0 0 0 0 0.7797 -0.2393 -1.7792 C 0 0 2 0 0 0 0 0 0 0 0 0 0.5478 1.0870 -1.4645 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.1166 1.8184 -2.3970 C 0 0 1 0 0 0 0 0 0 0 0 0 -0.1880 3.2485 -1.9168 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.8424 4.0387 -2.8564 O 0 0 0 0 0 0 0 0 0 0 0 0 0.4730 1.8182 -3.7699 C 0 0 2 0 0 0 0 0 0 0 0 0 -0.4913 1.6252 -4.7506 O 0 0 0 0 0 0 0 0 0 0 0 0 1.4557 0.6635 -3.8779 C 0 0 2 0 0 0 0 0 0 0 0 0 2.4906 0.9878 -2.9808 O 0 0 0 0 0 0 0 0 0 0 0 0 1.9347 0.3887 -5.2183 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1721 -0.0190 -6.2854 N 0 0 0 0 0 0 0 0 0 0 0 0 3.2194 0.5674 -5.3769 O 0 0 0 0 0 0 0 0 0 0 0 0 0.6670 -0.5131 -3.2599 C 0 0 1 0 0 0 0 0 0 0 0 0 1.4200 -1.6324 -3.6390 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.3869 -2.2959 3.5935 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.1550 -1.8971 4.6485 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.2025 -2.8930 5.5837 N 0 0 0 0 0 0 0 0 0 0 0 0 -2.4728 -3.9044 5.1204 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.9755 -3.5418 3.9109 N 0 0 0 0 0 0 0 0 0 0 0 0 4.8601 2.4400 3.6991 C 0 0 0 0 0 0 0 0 0 0 0 0 5.2771 3.6184 3.7520 O 0 0 0 0 0 0 0 0 0 0 0 0 5.1917 1.6064 2.6412 N 0 0 0 0 0 0 0 0 0 0 0 0 6.0556 1.8601 1.5419 C 0 0 0 0 0 0 0 0 0 0 0 0 5.8974 0.8119 0.4592 C 0 0 0 0 0 0 0 0 0 0 0 0 6.8616 0.9841 -0.6514 C 0 0 0 0 0 0 0 0 0 0 0 0 8.0490 1.4014 -0.7191 N 0 0 0 0 0 0 0 0 0 0 0 0 8.7459 1.4503 -1.8856 C 0 0 2 0 0 0 0 0 0 0 0 0 8.8382 2.7404 -2.6150 C 0 0 0 0 0 0 0 0 0 0 0 0 8.2843 3.9133 -2.5353 N 0 0 0 0 0 0 0 0 0 0 0 0 8.5555 4.8751 -3.3476 C 0 0 0 0 0 0 0 0 0 0 0 0 7.9791 6.2278 -3.2584 C 0 0 0 0 0 0 0 0 0 0 0 0 7.1201 6.5621 -2.2067 N 0 0 0 0 0 0 0 0 0 0 0 0 8.2328 7.1230 -4.1129 O 0 0 0 0 0 0 0 0 0 0 0 0 9.4906 4.6030 -4.3396 C 0 0 0 0 0 0 0 0 0 0 0 0 9.8924 2.9904 -4.0127 S 0 0 0 0 0 0 0 0 0 0 0 0 8.2104 0.4132 -2.8977 C 0 0 0 0 0 0 0 0 0 0 0 0 6.4444 0.5767 -2.3965 S 0 0 0 0 0 0 0 0 0 0 0 0 6.0337 0.6934 6.4725 H 0 0 0 0 0 0 0 0 0 0 0 0 4.5865 -0.0810 7.2197 H 0 0 0 0 0 0 0 0 0 0 0 0 5.5521 -0.9587 6.0229 H 0 0 0 0 0 0 0 0 0 0 0 0 4.0490 2.6781 5.6685 H 0 0 0 0 0 0 0 0 0 0 0 0 2.3164 1.2907 3.5848 H 0 0 0 0 0 0 0 0 0 0 0 0 0.3053 1.8681 3.3501 H 0 0 0 0 0 0 0 0 0 0 0 0 1.1676 3.4622 1.9381 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5440 3.9619 2.1254 H 0 0 0 0 0 0 0 0 0 0 0 0 0.7944 4.7870 3.0816 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.8514 4.1334 5.0349 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0057 2.3928 6.3549 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.3040 3.4940 3.1080 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.2213 4.1900 5.1662 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.2123 2.7261 4.6850 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.8504 2.6094 5.9387 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.0979 0.6848 4.3556 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.9711 -0.7088 2.5398 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.8934 -0.9668 -0.1284 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.3881 -2.0907 -4.9705 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.3093 -0.6793 -4.9335 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.6981 -1.6829 -3.5311 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.4999 -2.9798 -5.5956 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.2187 -1.4358 -6.2969 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.0473 -3.1702 -2.4297 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.6818 -3.8648 -3.8498 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.4861 -4.4506 -5.0423 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.2979 -6.3096 -3.6838 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.6637 -4.6131 -1.7146 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.1874 -5.3038 -1.1656 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.2620 -6.5493 -5.4041 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.7118 -6.9824 -4.5942 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.6645 2.6278 -3.0895 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.6670 1.1961 -3.4420 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.3550 1.3426 0.3117 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.5691 2.4848 -1.0487 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.0596 2.5892 -0.1023 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.5346 -2.4122 1.5615 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.4182 -2.7341 0.3123 H 0 0 0 0 0 0 0 0 0 0 0 0 0.7814 -2.6635 2.9804 H 0 0 0 0 0 0 0 0 0 0 0 0 0.9603 -5.2002 3.2883 H 0 0 0 0 0 0 0 0 0 0 0 0 2.1461 -5.2161 1.9585 H 0 0 0 0 0 0 0 0 0 0 0 0 2.4368 -3.5351 4.2765 H 0 0 0 0 0 0 0 0 0 0 0 0 2.9244 -2.2757 2.1936 H 0 0 0 0 0 0 0 0 0 0 0 0 3.8784 -3.3639 0.5757 H 0 0 0 0 0 0 0 0 0 0 0 0 2.5622 -1.0357 0.1538 H 0 0 0 0 0 0 0 0 0 0 0 0 1.5478 -0.8424 2.5894 H 0 0 0 0 0 0 0 0 0 0 0 0 0.2057 -3.2233 -1.8110 H 0 0 0 0 0 0 0 0 0 0 0 0 0.8688 -4.0031 -0.3798 H 0 0 0 0 0 0 0 0 0 0 0 0 1.9226 -3.0030 -1.3756 H 0 0 0 0 0 0 0 0 0 0 0 0 1.8872 -0.3983 -1.5908 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.1642 1.4573 -2.4642 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.6812 3.3126 -0.9157 H 0 0 0 0 0 0 0 0 0 0 0 0 0.8507 3.6246 -1.8314 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.6639 3.5882 -3.1981 H 0 0 0 0 0 0 0 0 0 0 0 0 1.0251 2.7432 -4.0199 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.7499 2.4529 -5.1937 H 0 0 0 0 0 0 0 0 0 0 0 0 2.6487 1.9812 -3.0830 H 0 0 0 0 0 0 0 0 0 0 0 0 1.0850 -1.0519 -6.4958 H 0 0 0 0 0 0 0 0 0 0 0 0 0.7018 0.7245 -6.8734 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.3517 -0.5580 -3.6464 H 0 0 0 0 0 0 0 0 0 0 0 0 2.3613 -1.4779 -3.3194 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.6865 -0.9786 4.7997 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.2791 -4.8778 5.6021 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.3692 -4.1910 3.3582 H 0 0 0 0 0 0 0 0 0 0 0 0 4.7284 0.6263 2.6441 H 0 0 0 0 0 0 0 0 0 0 0 0 5.9113 2.8783 1.1503 H 0 0 0 0 0 0 0 0 0 0 0 0 7.1552 1.7864 1.8493 H 0 0 0 0 0 0 0 0 0 0 0 0 5.8453 -0.2160 0.7940 H 0 0 0 0 0 0 0 0 0 0 0 0 4.8519 1.0183 0.0245 H 0 0 0 0 0 0 0 0 0 0 0 0 9.8223 1.1193 -1.6352 H 0 0 0 0 0 0 0 0 0 0 0 0 6.1217 6.2775 -2.1980 H 0 0 0 0 0 0 0 0 0 0 0 0 7.4428 7.1303 -1.3625 H 0 0 0 0 0 0 0 0 0 0 0 0 9.8617 5.2878 -5.1264 H 0 0 0 0 0 0 0 0 0 0 0 0 8.5627 -0.6127 -2.6524 H 0 0 0 0 0 0 0 0 0 0 0 0 8.3401 0.7222 -3.9279 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 2 3 2 0 2 4 1 0 4 5 1 0 5 6 1 0 6 7 2 0 6 8 1 0 8 9 1 0 8 10 1 0 10 11 1 0 10 12 1 0 12 13 1 0 12 14 1 0 14 15 1 0 15 16 2 0 15 17 1 0 17 18 1 0 18 19 1 0 19 20 2 0 19 21 1 0 21 22 2 0 22 23 1 0 23 24 1 0 24 25 1 0 25 26 1 0 26 27 1 0 26 28 2 0 24 29 1 0 29 30 1 0 30 31 1 0 31 32 1 0 31 33 1 0 33 34 1 0 33 35 2 0 23 36 2 0 36 37 1 0 37 38 1 0 37 39 2 0 39 40 1 0 17 41 1 0 41 42 1 0 42 43 1 0 43 44 1 0 44 45 1 0 45 46 1 0 46 47 1 0 45 48 1 0 48 49 1 0 48 50 1 0 50 51 1 0 50 52 1 0 52 53 1 0 52 54 1 6 54 55 1 0 55 56 1 0 56 57 1 0 57 58 1 0 58 59 1 0 57 60 1 0 60 61 1 0 60 62 1 0 62 63 1 1 62 64 1 0 64 65 1 0 64 66 2 0 62 67 1 0 67 68 1 0 41 69 1 0 69 70 2 0 70 71 1 0 71 72 2 0 72 73 1 0 4 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 2 0 80 81 1 0 81 82 1 0 82 83 2 0 83 84 1 0 84 85 1 0 85 86 1 0 85 87 2 0 84 88 2 0 88 89 1 0 81 90 1 0 90 91 1 0 39 21 1 0 52 43 1 0 67 55 1 0 73 69 1 0 91 79 1 0 89 82 1 0 1 92 1 0 1 93 1 0 1 94 1 0 4 95 1 1 5 96 1 0 8 97 1 6 9 98 1 0 9 99 1 0 9100 1 0 10101 1 1 11102 1 0 12103 1 6 13104 1 0 13105 1 0 13106 1 0 14107 1 0 17108 1 1 18109 1 0 24110 1 6 25111 1 0 25112 1 0 27113 1 0 27114 1 0 29115 1 0 30116 1 0 30117 1 0 31118 1 6 32119 1 0 32120 1 0 34121 1 0 34122 1 0 38123 1 0 38124 1 0 40125 1 0 40126 1 0 40127 1 0 41128 1 6 43129 1 6 45130 1 1 46131 1 0 46132 1 0 47133 1 0 48134 1 1 49135 1 0 50136 1 6 51137 1 0 53138 1 0 53139 1 0 53140 1 0 55141 1 1 57142 1 6 58143 1 0 58144 1 0 59145 1 0 60146 1 6 61147 1 0 63148 1 0 65149 1 0 65150 1 0 67151 1 6 68152 1 0 70153 1 0 72154 1 0 73155 1 0 76156 1 0 77157 1 0 77158 1 0 78159 1 0 78160 1 0 81161 1 1 86162 1 0 86163 1 0 88164 1 0 90165 1 0 90166 1 0 M END