RDKit 3D 111116 0 0 0 0 0 0 0 0999 V2000 -9.0555 2.6266 -0.4954 C 0 0 0 0 0 0 0 0 0 0 0 0 -8.2862 2.2002 0.7018 C 0 0 0 0 0 0 0 0 0 0 0 0 -8.9089 1.7706 1.7066 O 0 0 0 0 0 0 0 0 0 0 0 0 -6.8999 2.2486 0.7781 O 0 0 0 0 0 0 0 0 0 0 0 0 -6.2116 1.8219 1.9629 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.7307 1.9848 1.7696 C 0 0 1 0 0 0 0 0 0 0 0 0 -4.2460 1.2359 0.7031 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.8358 1.3779 0.7291 C 0 0 1 0 0 0 0 0 0 0 0 0 -2.2366 0.3342 0.0552 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.5566 -0.5442 0.8905 C 0 0 1 0 0 0 0 0 0 0 0 0 -2.4298 -1.7915 0.9093 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.8624 -2.9782 0.2558 C 0 0 1 0 0 0 0 0 0 0 0 0 -2.8585 -4.1093 0.1447 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.1521 -4.6221 1.5645 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.1616 -3.7913 -0.4812 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.2796 -5.2698 -0.5870 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.6860 -6.3803 -0.2694 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.2672 -5.1340 -1.6463 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.4313 -3.9248 -1.5832 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.1376 -2.6797 -1.0140 C 0 0 1 0 0 0 0 0 0 0 0 0 -2.1517 -2.3329 -2.0894 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.1365 -1.5719 -0.8777 C 0 0 2 0 0 0 0 0 0 0 0 0 1.2639 -1.9014 -1.2315 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0383 -0.6275 -1.4514 C 0 0 0 0 0 0 0 0 0 0 0 0 1.7082 0.5156 -0.5917 C 0 0 1 0 0 0 0 0 0 0 0 0 0.5272 1.3183 -0.9497 C 0 0 0 0 0 0 0 0 0 0 0 0 0.5281 0.5020 0.2561 C 0 0 2 0 0 0 0 0 0 0 0 0 0.8279 1.2970 1.5370 C 0 0 0 0 0 0 0 0 0 0 0 0 2.2226 1.8614 1.3344 C 0 0 0 0 0 0 0 0 0 0 0 0 2.8256 1.0438 0.2514 C 0 0 2 0 0 0 0 0 0 0 0 0 3.9377 1.6876 -0.5301 C 0 0 1 0 0 0 0 0 0 0 0 0 3.5337 2.9558 -1.2385 C 0 0 0 0 0 0 0 0 0 0 0 0 5.1855 1.7632 0.2570 C 0 0 0 0 0 0 0 0 0 0 0 0 6.4411 2.0957 -0.4183 C 0 0 2 0 0 0 0 0 0 0 0 0 6.4216 3.3518 -1.0408 O 0 0 0 0 0 0 0 0 0 0 0 0 7.0016 1.1264 -1.3957 C 0 0 2 0 0 0 0 0 0 0 0 0 6.2978 0.9700 -2.5682 O 0 0 0 0 0 0 0 0 0 0 0 0 7.4547 -0.1888 -0.8541 C 0 0 0 0 0 0 0 0 0 0 0 0 8.3303 -0.0590 0.3626 C 0 0 0 0 0 0 0 0 0 0 0 0 6.3737 -1.2032 -0.6415 C 0 0 0 0 0 0 0 0 0 0 0 0 8.2909 -0.7408 -1.8620 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.1589 -0.8193 0.4241 C 0 0 1 0 0 0 0 0 0 0 0 0 0.6374 -1.5322 1.5297 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.5491 2.7487 0.2250 C 0 0 1 0 0 0 0 0 0 0 0 0 -3.4320 2.9809 -0.8457 O 0 0 0 0 0 0 0 0 0 0 0 0 -3.0121 3.7419 1.3114 C 0 0 2 0 0 0 0 0 0 0 0 0 -2.2162 3.6768 2.4304 O 0 0 0 0 0 0 0 0 0 0 0 0 -4.4521 3.4634 1.5817 C 0 0 2 0 0 0 0 0 0 0 0 0 -4.8224 4.0862 2.7812 O 0 0 0 0 0 0 0 0 0 0 0 0 -9.3876 3.6854 -0.4455 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.4630 2.5434 -1.4341 H 0 0 0 0 0 0 0 0 0 0 0 0 -9.9843 2.0227 -0.6171 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.4106 0.7553 2.1722 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.5820 2.4279 2.8132 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.2406 1.6838 2.7273 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.5689 1.3018 1.7999 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.5650 -0.0830 1.9127 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.5457 -2.0487 2.0123 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.4825 -1.5217 0.6273 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.1141 -3.4106 1.0050 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.8355 -5.4864 1.4157 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.2081 -5.0261 1.9945 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.6502 -3.8771 2.1803 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.8859 -4.5934 -0.1191 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.1815 -3.9700 -1.5981 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.6497 -2.8581 -0.2068 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.6178 -6.0316 -1.6232 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.8354 -5.2241 -2.6205 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5346 -4.0994 -1.1142 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.2121 -3.6452 -2.6588 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.3235 -3.1383 -2.8237 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.0569 -1.8600 -1.6912 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.6556 -1.5238 -2.7082 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.4421 -0.7887 -1.6396 H 0 0 0 0 0 0 0 0 0 0 0 0 1.3620 -2.4654 -2.1930 H 0 0 0 0 0 0 0 0 0 0 0 0 1.8427 -2.4959 -0.5100 H 0 0 0 0 0 0 0 0 0 0 0 0 3.1367 -0.8778 -1.4136 H 0 0 0 0 0 0 0 0 0 0 0 0 1.8666 -0.3300 -2.5290 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0004 1.1251 -1.8889 H 0 0 0 0 0 0 0 0 0 0 0 0 0.6532 2.4395 -0.8354 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0633 2.1295 1.5297 H 0 0 0 0 0 0 0 0 0 0 0 0 0.6669 0.7592 2.4533 H 0 0 0 0 0 0 0 0 0 0 0 0 2.1185 2.9302 1.1133 H 0 0 0 0 0 0 0 0 0 0 0 0 2.7769 1.7425 2.2903 H 0 0 0 0 0 0 0 0 0 0 0 0 3.2893 0.1384 0.7528 H 0 0 0 0 0 0 0 0 0 0 0 0 4.1316 0.9564 -1.3772 H 0 0 0 0 0 0 0 0 0 0 0 0 3.2427 3.7712 -0.5747 H 0 0 0 0 0 0 0 0 0 0 0 0 4.3439 3.2623 -1.9573 H 0 0 0 0 0 0 0 0 0 0 0 0 2.7034 2.6668 -1.9548 H 0 0 0 0 0 0 0 0 0 0 0 0 5.2747 0.8408 0.8554 H 0 0 0 0 0 0 0 0 0 0 0 0 5.0234 2.5707 1.0374 H 0 0 0 0 0 0 0 0 0 0 0 0 7.2302 2.2041 0.3864 H 0 0 0 0 0 0 0 0 0 0 0 0 6.1367 4.0701 -0.4299 H 0 0 0 0 0 0 0 0 0 0 0 0 7.9744 1.6245 -1.7453 H 0 0 0 0 0 0 0 0 0 0 0 0 6.8728 0.7663 -3.3497 H 0 0 0 0 0 0 0 0 0 0 0 0 9.0537 -0.9269 0.3690 H 0 0 0 0 0 0 0 0 0 0 0 0 7.7263 -0.1895 1.2842 H 0 0 0 0 0 0 0 0 0 0 0 0 8.9555 0.8405 0.3438 H 0 0 0 0 0 0 0 0 0 0 0 0 6.1092 -1.3511 0.4420 H 0 0 0 0 0 0 0 0 0 0 0 0 6.7177 -2.2393 -0.9465 H 0 0 0 0 0 0 0 0 0 0 0 0 5.5253 -0.9758 -1.2854 H 0 0 0 0 0 0 0 0 0 0 0 0 9.2354 -0.6386 -1.6511 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0262 -1.6054 2.4450 H 0 0 0 0 0 0 0 0 0 0 0 0 1.0171 -2.5063 1.2650 H 0 0 0 0 0 0 0 0 0 0 0 0 1.5180 -0.9566 1.8676 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.5202 2.9806 -0.0375 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.3673 2.2557 -1.5144 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.9615 4.7780 0.8814 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.3090 3.9724 2.2176 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.0501 3.8527 0.7577 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.6526 5.0626 2.7510 H 0 0 0 0 0 0 0 0 0 0 0 0 32 31 1 0 31 33 1 0 33 34 1 0 34 35 1 0 34 36 1 0 36 37 1 0 36 38 1 0 38 39 1 0 38 40 1 0 38 41 1 0 31 30 1 0 30 29 1 0 29 28 1 0 27 28 1 1 27 26 1 0 25 26 1 6 25 24 1 0 24 23 1 0 23 22 1 0 22 20 1 0 20 21 1 6 20 19 1 0 19 18 1 0 18 16 1 0 16 17 2 0 16 13 1 0 13 14 1 0 13 15 1 0 13 12 1 0 12 11 1 0 11 10 1 0 10 9 1 0 9 8 1 0 8 7 1 0 7 6 1 0 6 5 1 0 5 4 1 0 4 2 1 0 2 1 1 0 2 3 2 0 6 48 1 0 48 49 1 0 48 46 1 0 46 47 1 0 46 44 1 0 44 45 1 0 10 42 1 0 42 43 1 1 25 30 1 0 42 22 1 0 25 27 1 0 12 20 1 0 44 8 1 0 42 27 1 0 32 87 1 0 32 88 1 0 32 89 1 0 31 86 1 6 33 90 1 0 33 91 1 0 34 92 1 1 35 93 1 0 36 94 1 6 37 95 1 0 39 96 1 0 39 97 1 0 39 98 1 0 40 99 1 0 40100 1 0 40101 1 0 41102 1 0 30 85 1 1 29 83 1 0 29 84 1 0 28 81 1 0 28 82 1 0 26 79 1 0 26 80 1 0 24 77 1 0 24 78 1 0 23 75 1 0 23 76 1 0 22 74 1 6 21 71 1 0 21 72 1 0 21 73 1 0 19 69 1 0 19 70 1 0 18 67 1 0 18 68 1 0 14 61 1 0 14 62 1 0 14 63 1 0 15 64 1 0 15 65 1 0 15 66 1 0 12 60 1 1 11 58 1 0 11 59 1 0 10 57 1 1 8 56 1 1 6 55 1 1 5 53 1 0 5 54 1 0 1 50 1 0 1 51 1 0 1 52 1 0 48110 1 6 49111 1 0 46108 1 6 47109 1 0 44106 1 6 45107 1 0 43103 1 0 43104 1 0 43105 1 0 M END