RDKit 3D 176185 0 0 0 0 0 0 0 0999 V2000 11.0747 -4.6666 -2.6472 C 0 0 0 0 0 0 0 0 0 0 0 0 9.7198 -4.4378 -2.2011 N 0 0 0 0 0 0 0 0 0 0 0 0 9.4345 -3.0481 -2.1623 C 0 0 2 0 0 0 0 0 0 0 0 0 10.2452 -2.2633 -1.2079 C 0 0 0 0 0 0 0 0 0 0 0 0 10.1537 -2.6373 0.2335 C 0 0 2 0 0 0 0 0 0 0 0 0 11.0837 -1.6395 0.9675 C 0 0 0 0 0 0 0 0 0 0 0 0 10.7937 -3.9997 0.5204 C 0 0 0 0 0 0 0 0 0 0 0 0 7.9799 -2.7156 -2.1110 C 0 0 0 0 0 0 0 0 0 0 0 0 7.1399 -3.6414 -2.1749 O 0 0 0 0 0 0 0 0 0 0 0 0 7.5921 -1.3910 -1.9941 N 0 0 0 0 0 0 0 0 0 0 0 0 6.1672 -0.9548 -1.9420 C 0 0 1 0 0 0 0 0 0 0 0 0 5.9809 -0.6176 -0.5137 C 0 0 0 0 0 0 0 0 0 0 0 0 6.8222 0.3273 -0.1422 O 0 0 0 0 0 0 0 0 0 0 0 0 5.1273 -1.1015 0.4603 N 0 0 0 0 0 0 0 0 0 0 0 0 3.7201 -1.1724 0.6811 C 0 0 1 0 0 0 0 0 0 0 0 0 3.1994 -2.5874 0.2805 C 0 0 0 0 0 0 0 0 0 0 0 0 3.8480 -3.6141 1.0773 C 0 0 0 0 0 0 0 0 0 0 0 0 3.2309 -4.0890 2.2598 N 0 0 0 0 0 0 0 0 0 0 0 0 4.9533 -4.0928 0.7382 O 0 0 0 0 0 0 0 0 0 0 0 0 3.4228 -0.9130 2.1080 C 0 0 0 0 0 0 0 0 0 0 0 0 4.4343 -0.7701 2.8846 O 0 0 0 0 0 0 0 0 0 0 0 0 2.1458 -0.8007 2.7414 N 0 0 0 0 0 0 0 0 0 0 0 0 1.0012 -0.2241 2.2691 C 0 0 1 0 0 0 0 0 0 0 0 0 -0.3512 -0.6853 2.6497 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.1624 0.1599 1.8887 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.9995 -1.5802 3.4367 N 0 0 0 0 0 0 0 0 0 0 0 0 -1.9913 -2.6137 3.2330 C 0 0 1 0 0 0 0 0 0 0 0 0 -3.4113 -2.1163 3.4631 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.5076 -1.6288 4.6819 O 0 0 0 0 0 0 0 0 0 0 0 0 -4.5604 -2.0619 2.7310 N 0 0 0 0 0 0 0 0 0 0 0 0 -5.1952 -1.3975 1.6319 C 0 0 2 0 0 0 0 0 0 0 0 0 -4.4740 -1.2378 0.3836 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.6070 -0.2588 0.3311 O 0 0 0 0 0 0 0 0 0 0 0 0 -4.5256 -1.9529 -0.8221 N 0 0 0 0 0 0 0 0 0 0 0 0 -4.7260 -3.2264 -1.2992 C 0 0 2 0 0 0 0 0 0 0 0 0 -5.1441 -4.3323 -0.3749 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.1626 -4.3536 0.8396 O 0 0 0 0 0 0 0 0 0 0 0 0 -5.5901 -5.5218 -1.0263 O 0 0 0 0 0 0 0 0 0 0 0 0 -3.6059 -3.8451 -2.1312 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.8344 -3.9140 -3.4675 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.9396 -4.5452 -4.3348 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.2261 -4.5879 -5.7111 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.8086 -5.1052 -3.8183 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.5776 -5.0342 -2.4656 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.4082 -5.6166 -1.9395 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.4504 -4.4091 -1.5828 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.0700 -4.3947 -0.1373 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.0315 -3.3258 0.7454 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.8591 -3.5639 2.0941 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.7037 -4.9059 2.5429 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.7282 -5.9766 1.6762 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.9116 -5.7214 0.3463 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.9297 -6.8353 -0.4774 O 0 0 0 0 0 0 0 0 0 0 0 0 -6.0226 -0.1151 2.0554 C 0 0 2 0 0 0 0 0 0 0 0 0 -7.1229 0.0073 1.4498 O 0 0 0 0 0 0 0 0 0 0 0 0 -8.2098 0.1239 0.8587 C 0 0 1 0 0 0 0 0 0 0 0 0 -8.7935 1.5507 1.2801 C 0 0 0 0 0 0 0 0 0 0 0 0 -10.1182 1.6930 0.5925 C 0 0 2 0 0 0 0 0 0 0 0 0 -10.8272 2.9067 1.1061 C 0 0 0 0 0 0 0 0 0 0 0 0 -10.9473 0.5023 0.7661 N 0 0 0 0 0 0 0 0 0 0 0 0 -9.7953 1.8973 -0.8821 C 0 0 1 0 0 0 0 0 0 0 0 0 -9.3933 3.2073 -1.0358 O 0 0 0 0 0 0 0 0 0 0 0 0 -8.6968 0.9705 -1.3318 C 0 0 1 0 0 0 0 0 0 0 0 0 -7.5682 1.8547 -1.9086 C 0 0 0 0 0 0 0 0 0 0 0 0 -8.1758 0.1099 -0.4829 O 0 0 0 0 0 0 0 0 0 0 0 0 -5.0437 1.0702 2.1636 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.2930 1.2843 3.2689 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.2405 2.2544 3.2637 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.9853 2.9686 2.1418 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.7089 2.8095 1.0498 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.7238 3.6699 -0.5471 Cl 0 0 0 0 0 0 0 0 0 0 0 0 -4.7658 1.8386 1.0461 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.8201 3.8948 2.2027 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.5575 3.1685 1.8786 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.1783 2.0087 2.5232 C 0 0 0 0 0 0 0 0 0 0 0 0 0.9928 1.3684 2.0852 C 0 0 0 0 0 0 0 0 0 0 0 0 1.7883 1.9045 1.0648 C 0 0 0 0 0 0 0 0 0 0 0 0 1.3693 3.0679 0.4543 C 0 0 0 0 0 0 0 0 0 0 0 0 0.2094 3.7044 0.8518 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.2056 4.8988 0.2217 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.0293 6.1111 0.9423 C 0 0 2 0 0 0 0 0 0 0 0 0 -1.0295 7.0195 0.7296 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.8829 7.7937 -0.4170 C 0 0 2 0 0 0 0 0 0 0 0 0 -0.8180 6.9852 -1.6832 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.6696 7.8914 -2.7415 O 0 0 0 0 0 0 0 0 0 0 0 0 0.3404 8.6684 -0.2361 C 0 0 2 0 0 0 0 0 0 0 0 0 0.4847 9.6159 -1.2151 O 0 0 0 0 0 0 0 0 0 0 0 0 1.5269 7.7255 -0.2339 C 0 0 1 0 0 0 0 0 0 0 0 0 2.6513 8.5081 0.1201 O 0 0 0 0 0 0 0 0 0 0 0 0 1.3621 6.6855 0.8401 C 0 0 1 0 0 0 0 0 0 0 0 0 1.6474 7.3140 2.0818 O 0 0 0 0 0 0 0 0 0 0 0 0 2.0296 3.7366 -0.6591 O 0 0 0 0 0 0 0 0 0 0 0 0 3.0065 2.8790 -1.3614 C 0 0 0 0 0 0 0 0 0 0 0 0 4.3016 3.0382 -0.9663 C 0 0 0 0 0 0 0 0 0 0 0 0 5.3091 2.2006 -1.5312 C 0 0 0 0 0 0 0 0 0 0 0 0 4.9980 1.2419 -2.4596 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7076 1.0943 -2.8675 C 0 0 0 0 0 0 0 0 0 0 0 0 2.7064 1.9626 -2.2812 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1412 1.6074 -3.1432 Cl 0 0 0 0 0 0 0 0 0 0 0 0 6.0361 0.2552 -2.8732 C 0 0 1 0 0 0 0 0 0 0 0 0 7.3410 0.6934 -3.0890 O 0 0 0 0 0 0 0 0 0 0 0 0 11.6330 -3.7588 -2.9046 H 0 0 0 0 0 0 0 0 0 0 0 0 11.0299 -5.3099 -3.5701 H 0 0 0 0 0 0 0 0 0 0 0 0 11.6815 -5.2490 -1.9163 H 0 0 0 0 0 0 0 0 0 0 0 0 9.0446 -4.9183 -2.8298 H 0 0 0 0 0 0 0 0 0 0 0 0 9.7408 -2.6574 -3.2001 H 0 0 0 0 0 0 0 0 0 0 0 0 10.1021 -1.1622 -1.3000 H 0 0 0 0 0 0 0 0 0 0 0 0 11.3383 -2.4110 -1.4819 H 0 0 0 0 0 0 0 0 0 0 0 0 9.1588 -2.5761 0.6785 H 0 0 0 0 0 0 0 0 0 0 0 0 10.7972 -0.5960 0.6958 H 0 0 0 0 0 0 0 0 0 0 0 0 11.0033 -1.7370 2.0617 H 0 0 0 0 0 0 0 0 0 0 0 0 12.1386 -1.8088 0.6855 H 0 0 0 0 0 0 0 0 0 0 0 0 11.8492 -3.9683 0.1060 H 0 0 0 0 0 0 0 0 0 0 0 0 10.9423 -4.0465 1.6386 H 0 0 0 0 0 0 0 0 0 0 0 0 10.2130 -4.8327 0.1294 H 0 0 0 0 0 0 0 0 0 0 0 0 8.3249 -0.6156 -1.9395 H 0 0 0 0 0 0 0 0 0 0 0 0 5.5687 -1.8161 -2.2195 H 0 0 0 0 0 0 0 0 0 0 0 0 5.6864 -1.5492 1.3062 H 0 0 0 0 0 0 0 0 0 0 0 0 3.1014 -0.5105 0.0719 H 0 0 0 0 0 0 0 0 0 0 0 0 3.4447 -2.7431 -0.8088 H 0 0 0 0 0 0 0 0 0 0 0 0 2.1001 -2.5380 0.3446 H 0 0 0 0 0 0 0 0 0 0 0 0 2.1974 -4.2028 2.3724 H 0 0 0 0 0 0 0 0 0 0 0 0 3.8440 -4.3532 3.0866 H 0 0 0 0 0 0 0 0 0 0 0 0 2.1112 -1.2453 3.7240 H 0 0 0 0 0 0 0 0 0 0 0 0 0.9163 -0.6371 1.1591 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.7722 -1.5052 4.5200 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.8012 -3.2249 4.2002 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.3038 -2.8081 3.1464 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.1265 -2.0108 1.2961 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.3617 -1.2487 -1.6830 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.6480 -3.1772 -1.9830 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.3554 -5.3863 -1.7222 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.7297 -3.4862 -3.9500 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.0472 -4.1853 -6.1077 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0834 -5.6085 -4.4568 H 0 0 0 0 0 0 0 0 0 0 0 0 0.2199 -6.0685 -2.5558 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.0100 -2.2372 0.3923 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.5549 -5.1052 3.6205 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.6006 -6.9806 2.0740 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.8188 -7.7420 -0.1284 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.3683 -0.5437 3.0495 H 0 0 0 0 0 0 0 0 0 0 0 0 -9.0888 -0.5590 1.1810 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.0729 2.2561 0.8535 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.8015 1.6334 2.3577 H 0 0 0 0 0 0 0 0 0 0 0 0 -10.1465 3.6462 1.5593 H 0 0 0 0 0 0 0 0 0 0 0 0 -11.3451 3.4317 0.2519 H 0 0 0 0 0 0 0 0 0 0 0 0 -11.6816 2.6194 1.7987 H 0 0 0 0 0 0 0 0 0 0 0 0 -11.2298 0.3297 1.7430 H 0 0 0 0 0 0 0 0 0 0 0 0 -11.7794 0.5694 0.1496 H 0 0 0 0 0 0 0 0 0 0 0 0 -10.6941 1.7369 -1.5041 H 0 0 0 0 0 0 0 0 0 0 0 0 -9.1715 3.6851 -0.2162 H 0 0 0 0 0 0 0 0 0 0 0 0 -9.0943 0.3664 -2.2360 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.6230 1.2742 -1.8659 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.5666 2.7982 -1.3581 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.8633 2.0657 -2.9674 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.3350 0.8422 4.3310 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.7571 2.3364 4.2994 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.2284 1.8823 0.0357 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.6283 1.7481 3.5633 H 0 0 0 0 0 0 0 0 0 0 0 0 2.8732 1.5326 0.9169 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0931 5.7849 2.0295 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.7717 8.4512 -0.4840 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.7990 6.4821 -1.8138 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0535 6.2074 -1.7033 H 0 0 0 0 0 0 0 0 0 0 0 0 0.2898 8.0353 -2.9611 H 0 0 0 0 0 0 0 0 0 0 0 0 0.2757 9.1150 0.7753 H 0 0 0 0 0 0 0 0 0 0 0 0 1.3544 10.0921 -1.0476 H 0 0 0 0 0 0 0 0 0 0 0 0 1.7456 7.2923 -1.2084 H 0 0 0 0 0 0 0 0 0 0 0 0 2.7363 8.5333 1.1116 H 0 0 0 0 0 0 0 0 0 0 0 0 2.1220 5.9348 0.7253 H 0 0 0 0 0 0 0 0 0 0 0 0 0.7704 7.7074 2.3604 H 0 0 0 0 0 0 0 0 0 0 0 0 4.7451 3.7795 -0.2393 H 0 0 0 0 0 0 0 0 0 0 0 0 6.2801 2.5561 -1.0777 H 0 0 0 0 0 0 0 0 0 0 0 0 3.2096 0.3989 -3.6002 H 0 0 0 0 0 0 0 0 0 0 0 0 5.8654 -0.1942 -3.9214 H 0 0 0 0 0 0 0 0 0 0 0 0 7.8462 0.1814 -3.7451 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 4 5 1 0 5 6 1 0 5 7 1 0 3 8 1 0 8 9 2 0 8 10 1 0 10 11 1 0 11 12 1 0 12 13 2 0 12 14 1 0 14 15 1 0 15 16 1 0 16 17 1 0 17 18 1 0 17 19 2 0 15 20 1 0 20 21 2 0 20 22 1 0 22 23 1 0 23 24 1 0 24 25 2 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 32 33 2 0 32 34 1 0 34 35 1 0 35 36 1 0 36 37 2 0 36 38 1 0 35 39 1 0 39 40 2 0 40 41 1 0 41 42 1 0 41 43 2 0 43 44 1 0 44 45 1 0 44 46 2 0 46 47 1 0 47 48 2 0 48 49 1 0 49 50 2 0 50 51 1 0 51 52 2 0 52 53 1 0 31 54 1 0 54 55 1 0 55 56 1 0 56 57 1 0 57 58 1 0 58 59 1 0 58 60 1 6 58 61 1 0 61 62 1 0 61 63 1 0 63 64 1 0 63 65 1 0 54 66 1 0 66 67 2 0 67 68 1 0 68 69 2 0 69 70 1 0 70 71 1 0 70 72 2 0 69 73 1 0 73 74 1 0 74 75 1 0 75 76 2 0 76 77 1 0 77 78 2 0 78 79 1 0 79 80 1 0 80 81 1 0 81 82 1 0 82 83 1 0 83 84 1 0 84 85 1 0 83 86 1 0 86 87 1 0 86 88 1 0 88 89 1 0 88 90 1 0 90 91 1 0 78 92 1 0 92 93 1 0 93 94 2 0 94 95 1 0 95 96 2 0 96 97 1 0 97 98 2 0 98 99 1 0 96100 1 0 100101 1 0 100 11 1 0 76 23 1 0 90 81 1 0 98 93 1 0 49 27 1 0 65 56 1 0 72 66 1 0 79 74 2 0 46 39 1 0 52 47 1 0 1102 1 0 1103 1 0 1104 1 0 2105 1 0 3106 1 6 4107 1 0 4108 1 0 5109 1 1 6110 1 0 6111 1 0 6112 1 0 7113 1 0 7114 1 0 7115 1 0 10116 1 0 11117 1 6 14118 1 0 15119 1 6 16120 1 0 16121 1 0 18122 1 0 18123 1 0 22124 1 0 23125 1 6 26126 1 0 27127 1 1 30128 1 0 31129 1 6 34130 1 0 35131 1 6 38132 1 0 40133 1 0 42134 1 0 43135 1 0 45136 1 0 48137 1 0 50138 1 0 51139 1 0 53140 1 0 54141 1 1 56142 1 1 57143 1 0 57144 1 0 59145 1 0 59146 1 0 59147 1 0 60148 1 0 60149 1 0 61150 1 6 62151 1 0 63152 1 6 64153 1 0 64154 1 0 64155 1 0 67156 1 0 68157 1 0 72158 1 0 75159 1 0 77160 1 0 81161 1 1 83162 1 6 84163 1 0 84164 1 0 85165 1 0 86166 1 1 87167 1 0 88168 1 6 89169 1 0 90170 1 6 91171 1 0 94172 1 0 95173 1 0 97174 1 0 100175 1 6 101176 1 0 M END