LHJ1A3 -OEChem-05032301073D 63 68 0 0 0 0 0 0 0999 V2000 -5.2449 -1.3787 -0.8075 S 0 0 0 0 0 0 0 0 0 0 0 0 4.5312 4.7583 -1.1832 F 0 0 0 0 0 0 0 0 0 0 0 0 5.9934 4.0421 0.2579 F 0 0 0 0 0 0 0 0 0 0 0 0 5.9944 3.2586 -1.7644 F 0 0 0 0 0 0 0 0 0 0 0 0 0.7769 -0.1264 0.8476 O 0 0 0 0 0 0 0 0 0 0 0 0 -3.8427 -1.3094 -0.4278 O 0 0 0 0 0 0 0 0 0 0 0 0 -5.9826 -2.6209 -0.6456 O 0 0 0 0 0 0 0 0 0 0 0 0 0.4110 -5.4063 -2.1118 O 0 0 0 0 0 0 0 0 0 0 0 0 0.0815 1.8611 -0.2178 N 0 0 0 0 0 0 0 0 0 0 0 0 3.5602 0.6998 0.4096 N 0 0 0 0 0 0 0 0 0 0 0 0 4.6780 1.3970 0.1289 N 0 0 0 0 0 0 0 0 0 0 0 0 1.5984 -3.8930 -0.7899 N 0 0 0 0 0 0 0 0 0 0 0 0 3.1414 -5.3052 -0.0015 N 0 0 0 0 0 0 0 0 0 0 0 0 2.2949 -5.9805 -0.8319 N 0 0 0 0 0 0 0 0 0 0 0 0 1.8280 3.6305 -0.7372 C 0 0 0 0 0 0 0 0 0 0 0 0 2.8066 2.6009 -0.3486 C 0 0 0 0 0 0 0 0 0 0 0 0 0.5096 2.9484 -1.1441 C 0 0 0 0 0 0 0 0 0 0 0 0 2.4082 1.3774 0.1327 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0410 0.9459 0.3086 C 0 0 0 0 0 0 0 0 0 0 0 0 4.2096 2.5615 -0.3325 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.3324 1.6481 -0.0292 C 0 0 0 0 0 0 0 0 0 0 0 0 3.6730 -0.5932 0.9206 C 0 0 0 0 0 0 0 0 0 0 0 0 5.1516 3.6171 -0.7408 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.2400 2.1049 -0.9848 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.7920 0.9855 1.1090 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.0672 1.2363 0.3358 C 0 0 0 0 0 0 0 0 0 0 0 0 3.1367 -1.6706 0.2155 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.6074 1.8988 -0.8023 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.1594 0.7796 1.2914 C 0 0 0 0 0 0 0 0 0 0 0 0 4.3232 -0.8091 2.1356 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.4855 1.0227 0.5251 C 0 0 0 0 0 0 0 0 0 0 0 0 3.2504 -2.9639 0.7256 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.1201 -0.1247 0.0494 C 0 0 0 0 0 0 0 0 0 0 0 0 4.4368 -2.1025 2.6457 C 0 0 0 0 0 0 0 0 0 0 0 0 3.9005 -3.1799 1.9408 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.2199 1.9960 1.2027 C 0 0 0 0 0 0 0 0 0 0 0 0 2.6925 -4.0880 -0.0095 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.4893 -0.2988 0.2512 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.5892 1.8218 1.4043 C 0 0 0 0 0 0 0 0 0 0 0 0 -8.2239 0.6745 0.9287 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.3488 -0.8937 -2.5139 C 0 0 0 0 0 0 0 0 0 0 0 0 1.3161 -5.1219 -1.3426 C 0 0 0 0 0 0 0 0 0 0 0 0 1.6497 4.2926 0.1188 H 0 0 0 0 0 0 0 0 0 0 0 0 2.1893 4.2457 -1.5670 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.2512 3.7343 -1.1944 H 0 0 0 0 0 0 0 0 0 0 0 0 0.6185 2.4907 -2.1356 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.9274 2.5949 -1.9016 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.1306 0.6622 1.9060 H 0 0 0 0 0 0 0 0 0 0 0 0 2.6598 -1.4947 -0.7463 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.3013 2.2596 -1.5578 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.5024 0.2731 2.1908 H 0 0 0 0 0 0 0 0 0 0 0 0 4.7434 0.0195 2.7006 H 0 0 0 0 0 0 0 0 0 0 0 0 4.9413 -2.2702 3.5928 H 0 0 0 0 0 0 0 0 0 0 0 0 3.9954 -4.1797 2.3564 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.7430 2.8972 1.5812 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.0112 -1.1778 -0.1162 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.1613 2.5798 1.9313 H 0 0 0 0 0 0 0 0 0 0 0 0 -9.2904 0.5402 1.0840 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.8345 -1.6508 -3.1101 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.3999 -0.8474 -2.8052 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.8670 0.0732 -2.6540 H 0 0 0 0 0 0 0 0 0 0 0 0 1.0743 -3.0393 -0.9403 H 0 0 0 0 0 0 0 0 0 0 0 0 2.4222 -6.9691 -1.0066 H 0 0 0 0 0 0 0 0 0 0 0 0 1 6 2 0 0 0 0 1 7 2 0 0 0 0 1 33 1 0 0 0 0 1 41 1 0 0 0 0 2 23 1 0 0 0 0 3 23 1 0 0 0 0 4 23 1 0 0 0 0 5 19 2 0 0 0 0 8 42 2 0 0 0 0 9 17 1 0 0 0 0 9 19 1 0 0 0 0 9 21 1 0 0 0 0 10 11 1 0 0 0 0 10 18 1 0 0 0 0 10 22 1 0 0 0 0 11 20 2 0 0 0 0 12 37 1 0 0 0 0 12 42 1 0 0 0 0 12 62 1 0 0 0 0 13 14 1 0 0 0 0 13 37 2 0 0 0 0 14 42 1 0 0 0 0 14 63 1 0 0 0 0 15 16 1 0 0 0 0 15 17 1 0 0 0 0 15 43 1 0 0 0 0 15 44 1 0 0 0 0 16 18 2 0 0 0 0 16 20 1 0 0 0 0 17 45 1 0 0 0 0 17 46 1 0 0 0 0 18 19 1 0 0 0 0 20 23 1 0 0 0 0 21 24 2 0 0 0 0 21 25 1 0 0 0 0 22 27 1 0 0 0 0 22 30 2 0 0 0 0 24 28 1 0 0 0 0 24 47 1 0 0 0 0 25 29 2 0 0 0 0 25 48 1 0 0 0 0 26 28 2 0 0 0 0 26 29 1 0 0 0 0 26 31 1 0 0 0 0 27 32 2 0 0 0 0 27 49 1 0 0 0 0 28 50 1 0 0 0 0 29 51 1 0 0 0 0 30 34 1 0 0 0 0 30 52 1 0 0 0 0 31 33 1 0 0 0 0 31 36 2 0 0 0 0 32 35 1 0 0 0 0 32 37 1 0 0 0 0 33 38 2 0 0 0 0 34 35 2 0 0 0 0 34 53 1 0 0 0 0 35 54 1 0 0 0 0 36 39 1 0 0 0 0 36 55 1 0 0 0 0 38 40 1 0 0 0 0 38 56 1 0 0 0 0 39 40 2 0 0 0 0 39 57 1 0 0 0 0 40 58 1 0 0 0 0 41 59 1 0 0 0 0 41 60 1 0 0 0 0 41 61 1 0 0 0 0 M END $$$$