RDKit 3D 99103 0 0 0 0 0 0 0 0999 V2000 -4.5701 1.7896 3.4416 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.2773 1.2657 2.9902 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.4113 1.0237 3.8998 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.9463 1.0215 1.6533 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.6109 0.4970 1.4198 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.4499 0.3111 -0.0346 C 0 0 2 0 0 0 0 0 0 0 0 0 -2.4243 -0.7566 -0.4218 C 0 0 2 0 0 0 0 0 0 0 0 0 -3.6872 -0.6698 0.1636 O 0 0 0 0 0 0 0 0 0 0 0 0 -4.8855 -0.4158 -0.4242 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.1588 -0.3489 0.3222 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.8674 -0.2366 -1.6491 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.8839 -2.1512 -0.1721 C 0 0 2 0 0 0 0 0 0 0 0 0 -2.7619 -2.8569 0.7375 O 0 0 0 0 0 0 0 0 0 0 0 0 -3.6138 -3.8656 0.3641 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.5112 -4.5850 1.3095 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.6180 -4.1868 -0.8740 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.4687 -2.3297 0.2074 C 0 0 2 0 0 0 0 0 0 0 0 0 0.2985 -1.0440 0.5901 C 0 0 1 0 0 0 0 0 0 0 0 0 1.6317 -1.1104 0.6085 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.1312 -0.2449 -0.5356 C 0 0 1 0 0 0 0 0 0 0 0 0 -0.1224 -1.2122 -1.5160 O 0 0 0 0 0 0 0 0 0 0 0 0 0.2624 -2.4404 -1.1566 C 0 0 2 0 0 0 0 0 0 0 0 0 -0.4796 -3.3991 -2.0909 C 0 0 0 0 0 0 0 0 0 0 0 0 1.5742 -2.9996 -0.8890 C 0 0 0 0 0 0 0 0 0 0 0 0 2.7141 -2.4754 -1.2997 O 0 0 0 0 0 0 0 0 0 0 0 0 3.8885 -2.4799 -1.9040 C 0 0 0 0 0 0 0 0 0 0 0 0 3.9909 -2.4927 -3.2140 O 0 0 0 0 0 0 0 0 0 0 0 0 5.2635 -2.4706 -1.3127 C 0 0 0 0 0 0 0 0 0 0 0 0 6.0919 -3.5120 -1.7718 C 0 0 0 0 0 0 0 0 0 0 0 0 7.3908 -3.7037 -1.3442 C 0 0 0 0 0 0 0 0 0 0 0 0 7.8649 -2.7999 -0.4147 C 0 0 0 0 0 0 0 0 0 0 0 0 7.0661 -1.8152 0.0099 N 0 0 0 0 0 0 0 0 0 0 0 0 5.7711 -1.6109 -0.4052 C 0 0 0 0 0 0 0 0 0 0 0 0 5.1809 -0.4306 0.2606 C 0 0 0 0 0 0 0 0 0 0 0 0 5.0999 0.8529 -0.4361 C 0 0 0 0 0 0 0 0 0 0 0 0 3.9683 1.6992 0.1553 C 0 0 1 0 0 0 0 0 0 0 0 0 4.6752 2.7226 1.0577 C 0 0 0 0 0 0 0 0 0 0 0 0 3.1902 2.4396 -0.8344 C 0 0 0 0 0 0 0 0 0 0 0 0 3.8765 2.8883 -1.8291 O 0 0 0 0 0 0 0 0 0 0 0 0 1.8638 2.7408 -0.8908 O 0 0 0 0 0 0 0 0 0 0 0 0 0.8070 2.0084 -0.3762 C 0 0 1 0 0 0 0 0 0 0 0 0 -0.5299 2.6489 -0.2908 C 0 0 2 0 0 0 0 0 0 0 0 0 -0.7331 3.3980 0.8771 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.9701 4.7347 0.8508 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.1858 5.5393 2.1098 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.0048 5.2930 -0.2742 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.7143 1.6963 -0.5466 C 0 0 2 0 0 0 0 0 0 0 0 0 -2.7764 2.3296 0.1965 O 0 0 0 0 0 0 0 0 0 0 0 0 -3.9148 2.8378 -0.3476 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.0063 3.4914 0.4285 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.0442 2.7414 -1.6209 O 0 0 0 0 0 0 0 0 0 0 0 0 0.5900 0.8003 -1.2435 C 0 0 1 0 0 0 0 0 0 0 0 0 1.7207 0.4680 -2.1532 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.2655 1.2604 -2.3007 O 0 0 0 0 0 0 0 0 0 0 0 0 -4.8253 1.3040 4.4044 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.4432 2.8813 3.6632 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.3873 1.7091 2.6992 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0321 1.2963 1.9160 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.6136 -0.3223 2.1255 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.6431 -0.5512 -1.4950 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.9638 -0.3083 1.4199 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.7238 -1.2799 0.1308 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.7809 0.5196 -0.0016 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.1430 -2.6742 -1.1254 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.9600 -4.8335 2.2215 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.4582 -4.0322 1.4814 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.7619 -5.5694 0.8131 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.2318 -3.1542 0.8598 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0185 -0.9115 1.6051 H 0 0 0 0 0 0 0 0 0 0 0 0 2.0392 -1.3174 1.5009 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9353 -4.2401 -1.5329 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0945 -2.9066 -2.8349 H 0 0 0 0 0 0 0 0 0 0 0 0 0.3052 -3.9349 -2.7194 H 0 0 0 0 0 0 0 0 0 0 0 0 1.6978 -3.3099 0.2169 H 0 0 0 0 0 0 0 0 0 0 0 0 1.5831 -4.0870 -1.2678 H 0 0 0 0 0 0 0 0 0 0 0 0 5.7494 -4.2437 -2.5253 H 0 0 0 0 0 0 0 0 0 0 0 0 8.0006 -4.5186 -1.7203 H 0 0 0 0 0 0 0 0 0 0 0 0 8.8827 -2.9342 -0.0642 H 0 0 0 0 0 0 0 0 0 0 0 0 5.7041 -0.1950 1.2518 H 0 0 0 0 0 0 0 0 0 0 0 0 4.1768 -0.7468 0.6011 H 0 0 0 0 0 0 0 0 0 0 0 0 6.0500 1.4469 -0.4398 H 0 0 0 0 0 0 0 0 0 0 0 0 4.8610 0.7121 -1.5053 H 0 0 0 0 0 0 0 0 0 0 0 0 3.3429 1.0912 0.8584 H 0 0 0 0 0 0 0 0 0 0 0 0 5.1202 2.1423 1.8663 H 0 0 0 0 0 0 0 0 0 0 0 0 5.4635 3.1846 0.4115 H 0 0 0 0 0 0 0 0 0 0 0 0 3.9232 3.4732 1.3532 H 0 0 0 0 0 0 0 0 0 0 0 0 1.2054 1.6121 0.5825 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5972 3.3674 -1.1333 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.4731 4.8603 2.9467 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.2097 5.9793 2.4094 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.9918 6.2747 2.0108 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.1413 1.7663 -1.5591 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.4319 4.3679 -0.1357 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.6767 3.8484 1.4097 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.8707 2.8060 0.5546 H 0 0 0 0 0 0 0 0 0 0 0 0 1.9193 1.2909 -2.8639 H 0 0 0 0 0 0 0 0 0 0 0 0 2.6228 0.0812 -1.6749 H 0 0 0 0 0 0 0 0 0 0 0 0 1.3601 -0.3808 -2.8099 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.3914 0.5819 -2.9849 H 0 0 0 0 0 0 0 0 0 0 0 0 37 36 1 0 36 35 1 0 35 34 1 0 34 33 1 0 33 32 2 0 32 31 1 0 31 30 2 0 30 29 1 0 29 28 2 0 28 26 1 0 26 27 2 0 26 25 1 0 25 24 1 0 24 22 1 0 22 23 1 6 22 21 1 0 20 21 1 6 20 18 1 0 18 19 1 0 18 17 1 0 17 12 1 0 12 13 1 0 13 14 1 0 14 15 1 0 14 16 2 0 12 7 1 0 7 8 1 0 8 9 1 0 9 10 1 0 9 11 2 0 7 6 1 0 6 5 1 1 5 4 1 0 4 2 1 0 2 1 1 0 2 3 2 0 6 47 1 0 47 48 1 0 48 49 1 0 49 50 1 0 49 51 2 0 47 42 1 0 42 43 1 0 43 44 1 0 44 45 1 0 44 46 2 0 42 41 1 0 41 40 1 0 40 38 1 0 38 39 2 0 41 52 1 0 52 53 1 0 52 54 1 6 38 36 1 0 28 33 1 0 17 22 1 0 6 20 1 0 52 20 1 0 37 84 1 0 37 85 1 0 37 86 1 0 36 83 1 1 35 81 1 0 35 82 1 0 34 79 1 0 34 80 1 0 31 78 1 0 30 77 1 0 29 76 1 0 24 74 1 0 24 75 1 0 23 71 1 0 23 72 1 0 23 73 1 0 18 69 1 1 19 70 1 0 17 68 1 1 12 64 1 6 15 65 1 0 15 66 1 0 15 67 1 0 7 60 1 6 10 61 1 0 10 62 1 0 10 63 1 0 5 58 1 0 5 59 1 0 1 55 1 0 1 56 1 0 1 57 1 0 47 92 1 6 50 93 1 0 50 94 1 0 50 95 1 0 42 88 1 6 45 89 1 0 45 90 1 0 45 91 1 0 41 87 1 1 53 96 1 0 53 97 1 0 53 98 1 0 54 99 1 0 M END