L2HYJ3 -OEChem-05022321473D 93 98 0 1 0 0 0 0 0999 V2000 4.5639 -2.5670 -1.3219 S 0 0 0 0 0 0 0 0 0 0 0 0 -2.6882 -0.9298 -2.4356 O 0 0 0 0 0 0 0 0 0 0 0 0 3.2495 1.0910 -0.0867 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.3951 -1.8349 0.3148 O 0 0 0 0 0 0 0 0 0 0 0 0 -4.7764 -1.0076 -0.8724 N 0 0 0 0 0 0 0 0 0 0 0 0 -1.4063 0.2305 -0.8763 N 0 0 0 0 0 0 0 0 0 0 0 0 1.0173 1.5284 -0.1911 N 0 0 0 0 0 0 0 0 0 0 0 0 2.3816 2.4305 1.5449 N 0 0 0 0 0 0 0 0 0 0 0 0 1.3994 -2.0552 -1.1513 N 0 0 0 0 0 0 0 0 0 0 0 0 -5.7344 1.8261 -0.4640 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.4798 1.3988 -1.2233 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.8714 0.1145 -0.6685 C 0 0 2 0 0 0 0 0 0 0 0 0 -5.3623 2.4665 0.8802 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.5801 2.7864 -1.3112 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.4606 -2.1070 0.0387 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.5981 2.9506 1.6353 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.8135 3.2710 -0.5524 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.4401 3.8985 0.7871 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.9710 -1.7992 1.4517 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.0639 -3.4117 -0.4942 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.6093 -0.2469 -1.4109 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.7107 -2.9656 2.4035 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.8038 -4.5759 0.4603 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.2992 -4.2688 1.8708 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.1415 -0.2437 -1.4505 C 0 0 1 0 0 0 0 0 0 0 0 0 -1.3159 1.0445 0.3457 C 0 0 0 0 0 0 0 0 0 0 0 0 0.9620 0.8127 -1.4622 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.2388 2.1183 0.2516 C 0 0 0 0 0 0 0 0 0 0 0 0 0.2577 -1.4516 -0.6523 C 0 0 0 0 0 0 0 0 0 0 0 0 2.1792 1.7290 0.4717 C 0 0 0 0 0 0 0 0 0 0 0 0 4.2689 1.1655 0.9087 C 0 0 2 0 0 0 0 0 0 0 0 0 3.8418 2.3679 1.7499 C 0 0 1 0 0 0 0 0 0 0 0 0 5.6636 1.1980 0.3365 C 0 0 0 0 0 0 0 0 0 0 0 0 4.4239 3.7199 1.3401 C 0 0 0 0 0 0 0 0 0 0 0 0 1.9765 -3.2470 -0.5733 C 0 0 0 0 0 0 0 0 0 0 0 0 5.8880 1.7580 -0.9210 C 0 0 0 0 0 0 0 0 0 0 0 0 6.7291 0.6677 1.0641 C 0 0 0 0 0 0 0 0 0 0 0 0 3.4024 -3.0341 -0.1537 C 0 0 0 0 0 0 0 0 0 0 0 0 7.1779 1.7879 -1.4511 C 0 0 0 0 0 0 0 0 0 0 0 0 8.0189 0.6977 0.5340 C 0 0 0 0 0 0 0 0 0 0 0 0 3.9548 -3.1627 1.1017 C 0 0 0 0 0 0 0 0 0 0 0 0 8.2433 1.2577 -0.7236 C 0 0 0 0 0 0 0 0 0 0 0 0 5.3498 -2.8737 1.1045 C 0 0 0 0 0 0 0 0 0 0 0 0 5.8108 -2.5354 -0.1487 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.3627 0.9492 -0.2604 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.7381 2.2081 -1.2192 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.7262 1.2429 -2.2835 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.6752 0.2353 0.3933 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.8269 1.7538 1.5162 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.6867 3.3160 0.7166 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.9750 3.6526 -1.6081 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.9003 2.2900 -2.2351 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.3743 -2.2646 0.0862 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.2915 3.4562 2.5579 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.2062 2.0869 1.9313 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.4929 2.4265 -0.3832 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.3576 4.0010 -1.1622 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.7573 -1.3135 -1.8445 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.3501 4.1723 1.3327 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.8808 4.8258 0.6121 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.0497 -1.5950 1.4233 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.4958 -0.9107 1.8788 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.6398 -3.6531 -1.4768 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.1471 -3.2979 -0.6338 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.1418 -2.7425 3.3861 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.6298 -3.0845 2.5480 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.7284 -4.7905 0.4897 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.2991 -5.4781 0.0842 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.0357 -5.0939 2.5419 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.3940 -4.1986 1.8649 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.3148 -0.5827 -2.4794 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.1132 0.3719 1.1858 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.2519 1.5601 0.5619 H 0 0 0 0 0 0 0 0 0 0 0 0 0.7204 1.5517 -2.2382 H 0 0 0 0 0 0 0 0 0 0 0 0 1.9221 0.3869 -1.7660 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5408 2.8874 -0.4702 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.1429 2.6145 1.2239 H 0 0 0 0 0 0 0 0 0 0 0 0 4.1636 0.2460 1.5015 H 0 0 0 0 0 0 0 0 0 0 0 0 4.0691 2.1882 2.8069 H 0 0 0 0 0 0 0 0 0 0 0 0 1.8229 -1.7022 -2.0041 H 0 0 0 0 0 0 0 0 0 0 0 0 4.2121 3.9546 0.2914 H 0 0 0 0 0 0 0 0 0 0 0 0 5.5066 3.7524 1.4960 H 0 0 0 0 0 0 0 0 0 0 0 0 3.9801 4.5202 1.9431 H 0 0 0 0 0 0 0 0 0 0 0 0 1.9251 -4.0335 -1.3348 H 0 0 0 0 0 0 0 0 0 0 0 0 1.3760 -3.5789 0.2805 H 0 0 0 0 0 0 0 0 0 0 0 0 5.0741 2.1807 -1.5036 H 0 0 0 0 0 0 0 0 0 0 0 0 6.5670 0.2315 2.0461 H 0 0 0 0 0 0 0 0 0 0 0 0 7.3529 2.2247 -2.4300 H 0 0 0 0 0 0 0 0 0 0 0 0 8.8484 0.2848 1.1005 H 0 0 0 0 0 0 0 0 0 0 0 0 3.3890 -3.4486 1.9792 H 0 0 0 0 0 0 0 0 0 0 0 0 9.2476 1.2809 -1.1363 H 0 0 0 0 0 0 0 0 0 0 0 0 5.9834 -2.9114 1.9811 H 0 0 0 0 0 0 0 0 0 0 0 0 6.8205 -2.2753 -0.4331 H 0 0 0 0 0 0 0 0 0 0 0 0 1 38 1 0 0 0 0 1 44 1 0 0 0 0 2 21 2 0 0 0 0 3 30 1 0 0 0 0 3 31 1 0 0 0 0 4 29 2 0 0 0 0 5 12 1 0 0 0 0 5 15 1 0 0 0 0 5 58 1 0 0 0 0 6 21 1 0 0 0 0 6 25 1 0 0 0 0 6 26 1 0 0 0 0 7 27 1 0 0 0 0 7 28 1 0 0 0 0 7 30 1 0 0 0 0 8 30 2 0 0 0 0 8 32 1 0 0 0 0 9 29 1 0 0 0 0 9 35 1 0 0 0 0 9 80 1 0 0 0 0 10 11 1 0 0 0 0 10 13 1 0 0 0 0 10 14 1 0 0 0 0 10 45 1 0 0 0 0 11 12 1 0 0 0 0 11 46 1 0 0 0 0 11 47 1 0 0 0 0 12 21 1 0 0 0 0 12 48 1 0 0 0 0 13 16 1 0 0 0 0 13 49 1 0 0 0 0 13 50 1 0 0 0 0 14 17 1 0 0 0 0 14 51 1 0 0 0 0 14 52 1 0 0 0 0 15 19 1 0 0 0 0 15 20 1 0 0 0 0 15 53 1 0 0 0 0 16 18 1 0 0 0 0 16 54 1 0 0 0 0 16 55 1 0 0 0 0 17 18 1 0 0 0 0 17 56 1 0 0 0 0 17 57 1 0 0 0 0 18 59 1 0 0 0 0 18 60 1 0 0 0 0 19 22 1 0 0 0 0 19 61 1 0 0 0 0 19 62 1 0 0 0 0 20 23 1 0 0 0 0 20 63 1 0 0 0 0 20 64 1 0 0 0 0 22 24 1 0 0 0 0 22 65 1 0 0 0 0 22 66 1 0 0 0 0 23 24 1 0 0 0 0 23 67 1 0 0 0 0 23 68 1 0 0 0 0 24 69 1 0 0 0 0 24 70 1 0 0 0 0 25 27 1 0 0 0 0 25 29 1 0 0 0 0 25 71 1 0 0 0 0 26 28 1 0 0 0 0 26 72 1 0 0 0 0 26 73 1 0 0 0 0 27 74 1 0 0 0 0 27 75 1 0 0 0 0 28 76 1 0 0 0 0 28 77 1 0 0 0 0 31 32 1 0 0 0 0 31 33 1 0 0 0 0 31 78 1 0 0 0 0 32 34 1 0 0 0 0 32 79 1 0 0 0 0 33 36 2 0 0 0 0 33 37 1 0 0 0 0 34 81 1 0 0 0 0 34 82 1 0 0 0 0 34 83 1 0 0 0 0 35 38 1 0 0 0 0 35 84 1 0 0 0 0 35 85 1 0 0 0 0 36 39 1 0 0 0 0 36 86 1 0 0 0 0 37 40 2 0 0 0 0 37 87 1 0 0 0 0 38 41 2 0 0 0 0 39 42 2 0 0 0 0 39 88 1 0 0 0 0 40 42 1 0 0 0 0 40 89 1 0 0 0 0 41 43 1 0 0 0 0 41 90 1 0 0 0 0 42 91 1 0 0 0 0 43 44 2 0 0 0 0 43 92 1 0 0 0 0 44 93 1 0 0 0 0 M END $$$$