RDKit 3D 85 89 0 0 0 0 0 0 0 0999 V2000 -8.4541 4.5290 1.3181 C 0 0 0 0 0 0 0 0 0 0 0 0 -8.1056 3.2796 0.5779 C 0 0 0 0 0 0 0 0 0 0 0 0 -8.9437 2.7120 -0.1645 O 0 0 0 0 0 0 0 0 0 0 0 0 -6.8448 2.7129 0.6891 O 0 0 0 0 0 0 0 0 0 0 0 0 -6.5788 1.5239 -0.0456 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.1932 1.0183 0.1877 C 0 0 2 0 0 0 0 0 0 0 0 0 -4.1957 1.9299 -0.1808 O 0 0 0 0 0 0 0 0 0 0 0 0 -3.0472 1.0867 -0.2894 C 0 0 1 0 0 0 0 0 0 0 0 0 -2.7260 0.6112 0.9720 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.5314 0.9600 1.4887 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.3220 0.4635 0.6915 C 0 0 1 0 0 0 0 0 0 0 0 0 0.8111 0.9075 1.3498 O 0 0 0 0 0 0 0 0 0 0 0 0 1.8862 0.0847 1.0641 C 0 0 1 0 0 0 0 0 0 0 0 0 3.1071 0.7963 1.2839 O 0 0 0 0 0 0 0 0 0 0 0 0 4.0779 0.7652 0.2940 C 0 0 0 0 0 0 0 0 0 0 0 0 5.1751 -0.0347 0.3490 C 0 0 0 0 0 0 0 0 0 0 0 0 5.5152 -0.9451 1.4542 C 0 0 0 0 0 0 0 0 0 0 0 0 4.9669 -0.9272 2.6990 C 0 0 0 0 0 0 0 0 0 0 0 0 5.3073 -1.8358 3.6992 C 0 0 0 0 0 0 0 0 0 0 0 0 6.2414 -2.8165 3.4598 C 0 0 0 0 0 0 0 0 0 0 0 0 6.5866 -3.7284 4.4552 O 0 0 0 0 0 0 0 0 0 0 0 0 6.8074 -2.8476 2.2048 C 0 0 0 0 0 0 0 0 0 0 0 0 7.7524 -3.8285 1.9428 O 0 0 0 0 0 0 0 0 0 0 0 0 6.4595 -1.9381 1.2197 C 0 0 0 0 0 0 0 0 0 0 0 0 6.0103 0.0222 -0.6908 O 0 0 0 0 0 0 0 0 0 0 0 0 5.8504 0.7814 -1.7303 C 0 0 0 0 0 0 0 0 0 0 0 0 6.7644 0.7923 -2.7825 C 0 0 0 0 0 0 0 0 0 0 0 0 6.6363 1.5793 -3.8991 C 0 0 0 0 0 0 0 0 0 0 0 0 7.5967 1.5420 -4.9257 O 0 0 0 0 0 0 0 0 0 0 0 0 5.5300 2.4052 -3.9714 C 0 0 0 0 0 0 0 0 0 0 0 0 4.5932 2.4378 -2.9638 C 0 0 0 0 0 0 0 0 0 0 0 0 3.4672 3.2519 -2.9916 O 0 0 0 0 0 0 0 0 0 0 0 0 4.7636 1.6247 -1.8521 C 0 0 0 0 0 0 0 0 0 0 0 0 3.8684 1.6046 -0.8112 C 0 0 0 0 0 0 0 0 0 0 0 0 2.8652 2.3525 -0.8769 O 0 0 0 0 0 0 0 0 0 0 0 0 1.7899 -1.2051 1.8127 C 0 0 2 0 0 0 0 0 0 0 0 0 2.5282 -2.1689 1.0995 O 0 0 0 0 0 0 0 0 0 0 0 0 0.3532 -1.6953 1.7542 C 0 0 1 0 0 0 0 0 0 0 0 0 -0.2289 -1.4660 2.9929 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.4245 -1.0402 0.6583 C 0 0 2 0 0 0 0 0 0 0 0 0 0.0376 -1.4882 -0.5671 O 0 0 0 0 0 0 0 0 0 0 0 0 -3.5484 -0.0652 -1.1150 C 0 0 2 0 0 0 0 0 0 0 0 0 -3.7812 0.4287 -2.4221 O 0 0 0 0 0 0 0 0 0 0 0 0 -3.3026 -0.1633 -3.5600 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.5634 0.3810 -4.9227 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.6218 -1.1964 -3.4718 O 0 0 0 0 0 0 0 0 0 0 0 0 -4.9486 -0.2621 -0.5157 C 0 0 1 0 0 0 0 0 0 0 0 0 -4.8871 -1.3167 0.4327 O 0 0 0 0 0 0 0 0 0 0 0 0 -5.6598 -2.4373 0.2809 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.6441 -3.5832 1.2329 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.4214 -2.5201 -0.7006 O 0 0 0 0 0 0 0 0 0 0 0 0 -7.8463 5.3859 0.9695 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.3406 4.3114 2.3937 H 0 0 0 0 0 0 0 0 0 0 0 0 -9.5096 4.7676 1.0767 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.3147 0.7816 0.3264 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.8030 1.6625 -1.1205 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.0687 0.8559 1.2942 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.2578 1.6922 -0.7363 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.4400 0.4639 2.4938 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.4415 2.0467 1.6937 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.3292 0.8910 -0.3214 H 0 0 0 0 0 0 0 0 0 0 0 0 1.8445 -0.1552 -0.0344 H 0 0 0 0 0 0 0 0 0 0 0 0 4.2400 -0.1708 2.9521 H 0 0 0 0 0 0 0 0 0 0 0 0 4.8425 -1.7837 4.6837 H 0 0 0 0 0 0 0 0 0 0 0 0 6.1347 -3.6506 5.3540 H 0 0 0 0 0 0 0 0 0 0 0 0 8.2228 -3.9285 1.0448 H 0 0 0 0 0 0 0 0 0 0 0 0 6.9185 -1.9770 0.2245 H 0 0 0 0 0 0 0 0 0 0 0 0 7.6271 0.1174 -2.6790 H 0 0 0 0 0 0 0 0 0 0 0 0 8.3883 2.2010 -4.8435 H 0 0 0 0 0 0 0 0 0 0 0 0 5.4013 3.0470 -4.8529 H 0 0 0 0 0 0 0 0 0 0 0 0 3.2638 3.8690 -3.7566 H 0 0 0 0 0 0 0 0 0 0 0 0 2.0967 -1.1330 2.8548 H 0 0 0 0 0 0 0 0 0 0 0 0 2.4396 -1.9702 0.1194 H 0 0 0 0 0 0 0 0 0 0 0 0 0.3529 -2.7969 1.5911 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0103 -2.2368 3.5886 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.5024 -1.3339 0.7355 H 0 0 0 0 0 0 0 0 0 0 0 0 0.1380 -2.4688 -0.5282 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.9459 -0.9661 -1.0928 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.4906 1.0047 -4.9171 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.7015 -0.4284 -5.6836 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.7281 1.0052 -5.2903 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.6753 -0.4888 -1.3248 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.6665 -3.7936 1.5938 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.0276 -3.4017 2.1253 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.2063 -4.4934 0.7391 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 1 0 7 8 1 0 8 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 1 0 15 16 2 0 16 25 1 0 25 26 1 0 26 27 2 0 27 28 1 0 28 29 1 0 28 30 2 0 30 31 1 0 31 32 1 0 31 33 2 0 33 34 1 0 34 35 2 0 16 17 1 0 17 18 2 0 18 19 1 0 19 20 2 0 20 21 1 0 20 22 1 0 22 23 1 0 22 24 2 0 13 36 1 0 36 37 1 0 36 38 1 0 38 39 1 0 38 40 1 0 40 41 1 0 8 42 1 0 42 43 1 0 43 44 1 0 44 45 1 0 44 46 2 0 42 47 1 0 47 48 1 0 48 49 1 0 49 50 1 0 49 51 2 0 47 6 1 0 40 11 1 0 34 15 1 0 24 17 1 0 33 26 1 0 1 52 1 0 1 53 1 0 1 54 1 0 5 55 1 0 5 56 1 0 6 57 1 1 8 58 1 6 10 59 1 0 10 60 1 0 11 61 1 6 13 62 1 6 27 68 1 0 29 69 1 0 30 70 1 0 32 71 1 0 18 63 1 0 19 64 1 0 21 65 1 0 23 66 1 0 24 67 1 0 36 72 1 1 37 73 1 0 38 74 1 6 39 75 1 0 40 76 1 1 41 77 1 0 42 78 1 6 45 79 1 0 45 80 1 0 45 81 1 0 47 82 1 6 50 83 1 0 50 84 1 0 50 85 1 0 M END