RDKit 3D 115117 0 0 0 0 0 0 0 0999 V2000 -5.7089 -2.4422 -0.9712 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.0219 -3.3245 0.0155 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.0906 -3.8297 0.9867 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.9116 -2.6266 0.7947 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.8396 -2.1082 -0.1479 C 0 0 2 0 0 0 0 0 0 0 0 0 -3.2800 -1.1847 -1.0884 N 0 0 0 0 0 0 0 0 0 0 0 0 -3.4919 -0.0139 -1.3229 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.9936 0.3911 -2.5885 O 0 0 0 0 0 0 0 0 0 0 0 0 -3.2735 1.1036 -0.3823 C 0 0 2 0 0 0 0 0 0 0 0 0 -4.6005 1.2864 0.3913 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.4585 1.8753 -0.6744 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.5680 2.8454 -1.3768 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.2198 2.4047 -1.0927 N 0 0 0 0 0 0 0 0 0 0 0 0 -2.0011 3.0361 -1.4034 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.8481 3.6516 -2.4928 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.7857 3.0470 -0.5023 C 0 0 2 0 0 0 0 0 0 0 0 0 -0.6620 4.4878 -0.0414 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.7991 5.0254 0.6833 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.8877 4.9006 2.0502 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.9721 5.4345 2.7517 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.9768 6.0984 2.0841 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.0416 6.6173 2.8171 O 0 0 0 0 0 0 0 0 0 0 0 0 -3.8975 6.2270 0.7280 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.8095 5.6894 0.0402 C 0 0 0 0 0 0 0 0 0 0 0 0 0.2581 2.5467 -1.2039 N 0 0 0 0 0 0 0 0 0 0 0 0 1.1743 2.1116 -1.8091 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1750 1.5946 -3.1302 O 0 0 0 0 0 0 0 0 0 0 0 0 2.5546 2.0637 -1.1722 C 0 0 1 0 0 0 0 0 0 0 0 0 3.0301 3.5215 -0.9734 C 0 0 0 0 0 0 0 0 0 0 0 0 4.3966 3.4814 -0.3499 C 0 0 0 0 0 0 0 0 0 0 0 0 4.9281 4.8931 -0.1063 C 0 0 0 0 0 0 0 0 0 0 0 0 5.3322 2.7938 -1.3562 C 0 0 0 0 0 0 0 0 0 0 0 0 2.5349 1.4583 0.0926 N 0 0 0 0 0 0 0 0 0 0 0 0 2.9034 0.3595 0.5759 C 0 0 0 0 0 0 0 0 0 0 0 0 2.7127 0.0855 1.9659 O 0 0 0 0 0 0 0 0 0 0 0 0 3.5460 -0.7031 -0.2394 C 0 0 1 0 0 0 0 0 0 0 0 0 4.8807 -1.1197 0.3674 C 0 0 0 0 0 0 0 0 0 0 0 0 5.4616 -2.1985 -0.5465 C 0 0 0 0 0 0 0 0 0 0 0 0 5.6664 -1.6488 -1.9473 C 0 0 0 0 0 0 0 0 0 0 0 0 6.8120 -2.6597 -0.0439 C 0 0 0 0 0 0 0 0 0 0 0 0 2.7495 -1.7553 -0.6716 N 0 0 0 0 0 0 0 0 0 0 0 0 2.1518 -2.7608 -0.2861 C 0 0 0 0 0 0 0 0 0 0 0 0 1.4240 -3.5599 -1.2169 O 0 0 0 0 0 0 0 0 0 0 0 0 2.0768 -3.2912 1.1018 C 0 0 2 0 0 0 0 0 0 0 0 0 2.8337 -4.5586 1.2630 C 0 0 0 0 0 0 0 0 0 0 0 0 2.7127 -5.0485 2.7244 C 0 0 0 0 0 0 0 0 0 0 0 0 2.5360 -5.7097 0.4049 C 0 0 0 0 0 0 0 0 0 0 0 0 0.8418 -3.1437 1.7082 N 0 0 0 0 0 0 0 0 0 0 0 0 -0.3172 -3.4468 1.8101 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.1559 -2.8229 2.7750 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.0166 -4.4653 0.9897 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.4855 -4.0780 -0.2588 N 0 0 0 0 0 0 0 0 0 0 0 0 -2.1622 -3.2378 -0.8292 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.3541 -3.2843 -2.2248 O 0 0 0 0 0 0 0 0 0 0 0 0 -5.1921 -2.3343 -1.9271 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.8939 -1.4328 -0.5565 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.7213 -2.8697 -1.1919 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.5701 -4.2281 -0.4402 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.9339 -3.1052 1.0456 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.5051 -4.7932 0.6718 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.6711 -3.8811 2.0134 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.5119 -3.4006 1.4797 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.3681 -1.8730 1.4254 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.1065 -1.5699 0.5289 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.2865 -0.2659 -3.2819 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.4170 0.9984 0.2809 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.4018 2.0471 1.1737 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.9454 0.3213 0.7718 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.8434 1.1069 -1.3768 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.2993 2.4458 -0.2026 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.7665 3.9018 -1.0675 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.8009 2.7486 -2.4747 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9929 2.4419 0.4114 H 0 0 0 0 0 0 0 0 0 0 0 0 0.2419 4.6235 0.6255 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.4497 5.1634 -0.9184 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.1280 4.3860 2.6485 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.0317 5.3329 3.8131 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.0494 7.5596 3.2068 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.6860 6.7517 0.1821 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.7475 5.7926 -1.0317 H 0 0 0 0 0 0 0 0 0 0 0 0 1.8797 1.9447 -3.7745 H 0 0 0 0 0 0 0 0 0 0 0 0 3.3102 1.6261 -1.8243 H 0 0 0 0 0 0 0 0 0 0 0 0 3.0143 4.0627 -1.9198 H 0 0 0 0 0 0 0 0 0 0 0 0 2.3397 3.9441 -0.2177 H 0 0 0 0 0 0 0 0 0 0 0 0 4.4631 2.9334 0.5869 H 0 0 0 0 0 0 0 0 0 0 0 0 6.0453 4.7590 -0.0116 H 0 0 0 0 0 0 0 0 0 0 0 0 4.5653 5.2342 0.8703 H 0 0 0 0 0 0 0 0 0 0 0 0 4.6816 5.5583 -0.9431 H 0 0 0 0 0 0 0 0 0 0 0 0 6.3468 3.2365 -1.1745 H 0 0 0 0 0 0 0 0 0 0 0 0 5.3251 1.7183 -1.1134 H 0 0 0 0 0 0 0 0 0 0 0 0 4.9562 3.0556 -2.3556 H 0 0 0 0 0 0 0 0 0 0 0 0 2.6728 0.8815 2.5890 H 0 0 0 0 0 0 0 0 0 0 0 0 3.8806 -0.1577 -1.1918 H 0 0 0 0 0 0 0 0 0 0 0 0 5.5693 -0.2392 0.2684 H 0 0 0 0 0 0 0 0 0 0 0 0 4.8273 -1.4278 1.4056 H 0 0 0 0 0 0 0 0 0 0 0 0 4.7736 -3.0442 -0.6416 H 0 0 0 0 0 0 0 0 0 0 0 0 4.7859 -1.8031 -2.5998 H 0 0 0 0 0 0 0 0 0 0 0 0 6.5310 -2.1186 -2.4637 H 0 0 0 0 0 0 0 0 0 0 0 0 5.8610 -0.5625 -1.9245 H 0 0 0 0 0 0 0 0 0 0 0 0 6.7217 -3.4474 0.7284 H 0 0 0 0 0 0 0 0 0 0 0 0 7.4081 -2.9647 -0.9196 H 0 0 0 0 0 0 0 0 0 0 0 0 7.3121 -1.7444 0.3743 H 0 0 0 0 0 0 0 0 0 0 0 0 1.4462 -3.3998 -2.1936 H 0 0 0 0 0 0 0 0 0 0 0 0 2.7533 -2.5437 1.6814 H 0 0 0 0 0 0 0 0 0 0 0 0 3.9419 -4.3375 1.1692 H 0 0 0 0 0 0 0 0 0 0 0 0 1.7634 -5.6218 2.8548 H 0 0 0 0 0 0 0 0 0 0 0 0 3.6109 -5.6051 3.0270 H 0 0 0 0 0 0 0 0 0 0 0 0 2.5813 -4.1312 3.3342 H 0 0 0 0 0 0 0 0 0 0 0 0 1.8012 -6.4290 0.8865 H 0 0 0 0 0 0 0 0 0 0 0 0 3.4783 -6.3544 0.3879 H 0 0 0 0 0 0 0 0 0 0 0 0 2.3182 -5.5435 -0.6443 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.6626 -3.3875 3.4452 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.2897 -5.3302 0.8131 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.7894 -4.9993 1.6366 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.2077 -3.6385 -2.6250 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 2 0 7 8 1 0 7 9 1 0 9 10 1 0 10 11 1 0 11 12 1 0 12 13 1 0 13 14 1 0 14 15 2 0 14 16 1 0 16 17 1 0 17 18 1 0 18 19 2 0 19 20 1 0 20 21 2 0 21 22 1 0 21 23 1 0 23 24 2 0 16 25 1 0 25 26 2 3 26 27 1 0 26 28 1 0 28 29 1 0 29 30 1 0 30 31 1 0 30 32 1 0 28 33 1 0 33 34 2 0 34 35 1 0 34 36 1 0 36 37 1 0 37 38 1 0 38 39 1 0 38 40 1 0 36 41 1 0 41 42 2 0 42 43 1 0 42 44 1 0 44 48 1 0 48 49 2 0 49 50 1 0 49 51 1 0 51 52 1 0 52 53 2 0 53 54 1 0 44 45 1 0 45 46 1 0 45 47 1 0 53 5 1 0 13 9 1 0 24 18 1 0 1 55 1 0 1 56 1 0 1 57 1 0 2 58 1 0 3 59 1 0 3 60 1 0 3 61 1 0 4 62 1 0 4 63 1 0 5 64 1 1 8 65 1 0 9 66 1 1 10 67 1 0 10 68 1 0 11 69 1 0 11 70 1 0 12 71 1 0 12 72 1 0 16 73 1 1 17 74 1 0 17 75 1 0 19 76 1 0 20 77 1 0 22 78 1 0 23 79 1 0 24 80 1 0 27 81 1 0 28 82 1 6 29 83 1 0 29 84 1 0 30 85 1 0 31 86 1 0 31 87 1 0 31 88 1 0 32 89 1 0 32 90 1 0 32 91 1 0 35 92 1 0 36 93 1 6 37 94 1 0 37 95 1 0 38 96 1 0 39 97 1 0 39 98 1 0 39 99 1 0 40100 1 0 40101 1 0 40102 1 0 43103 1 0 44104 1 1 50112 1 0 51113 1 0 51114 1 0 54115 1 0 45105 1 0 46106 1 0 46107 1 0 46108 1 0 47109 1 0 47110 1 0 47111 1 0 M END