LJF8V9 -OEChem-05032301102D 50 53 0 1 0 0 0 0 0999 V2000 6.7619 -4.5707 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 2.8660 -5.7046 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 6.7619 -2.8386 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 3.9174 3.1351 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 3.3426 -1.4113 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 5.2066 4.2918 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 4.9889 -1.9494 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 5.5637 2.5970 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 4.5387 5.0361 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.5882 5.3468 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.3325 6.0146 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.2619 -3.7046 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 4.6783 -2.8999 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 4.6783 -4.5094 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7320 -3.2046 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7320 -4.2046 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.2619 -3.7046 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.8660 -2.7046 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.8660 -4.7046 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.8959 3.3413 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0000 -3.2046 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0000 -4.2046 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.3211 -1.2051 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.6318 -0.2546 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.2531 1.6465 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.6103 -0.0483 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.9639 0.4897 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.9209 0.9022 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.2746 1.4403 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.2001 4.5167 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.1003 5.7293 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.2962 4.7999 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.9078 6.2459 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.0049 6.5410 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.2908 -2.8037 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.5436 -3.1523 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.4272 -5.0763 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.2156 -4.8186 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.8132 4.4197 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.5956 -1.8215 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.8660 -2.0846 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.4631 -2.8946 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.4631 -4.5146 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.1704 2.7249 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.3819 -4.5707 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.3291 -6.0146 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.0243 -0.5098 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.3572 0.3619 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.5276 1.0300 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.8605 1.9017 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1 17 1 0 0 0 0 1 45 1 0 0 0 0 2 19 1 0 0 0 0 2 46 1 0 0 0 0 3 17 2 0 0 0 0 4 20 2 0 0 0 0 5 23 2 0 0 0 0 6 9 1 0 0 0 0 6 20 1 0 0 0 0 6 39 1 0 0 0 0 13 7 1 1 0 0 0 7 23 1 0 0 0 0 7 40 1 0 0 0 0 8 20 1 0 0 0 0 8 25 1 0 0 0 0 8 44 1 0 0 0 0 9 10 1 0 0 0 0 9 11 1 0 0 0 0 9 30 1 0 0 0 0 10 11 1 0 0 0 0 10 31 1 0 0 0 0 10 32 1 0 0 0 0 11 33 1 0 0 0 0 11 34 1 0 0 0 0 12 13 1 0 0 0 0 12 14 1 0 0 0 0 12 17 1 1 0 0 0 12 36 1 0 0 0 0 13 15 1 0 0 0 0 13 35 1 0 0 0 0 14 16 1 0 0 0 0 14 37 1 0 0 0 0 14 38 1 0 0 0 0 15 16 2 0 0 0 0 15 18 1 0 0 0 0 16 19 1 0 0 0 0 18 21 2 0 0 0 0 18 41 1 0 0 0 0 19 22 2 0 0 0 0 21 22 1 0 0 0 0 21 42 1 0 0 0 0 22 43 1 0 0 0 0 23 24 1 0 0 0 0 24 26 2 0 0 0 0 24 27 1 0 0 0 0 25 28 2 0 0 0 0 25 29 1 0 0 0 0 26 28 1 0 0 0 0 26 47 1 0 0 0 0 27 29 2 0 0 0 0 27 48 1 0 0 0 0 28 49 1 0 0 0 0 29 50 1 0 0 0 0 M END $$$$