B5XRT1 -OEChem-04012116062D 48 51 0 0 0 0 0 0 0999 V2000 6.2619 -1.7754 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 5.6103 1.8809 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 13.4383 3.5306 0.0000 O 0 5 0 0 0 0 0 0 0 0 0 0 13.7955 1.8358 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 4.6783 -2.5801 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 4.9889 -0.0201 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 8.9030 0.8047 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 5.9674 0.1861 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 13.1276 2.5801 0.0000 N 0 3 0 0 0 0 0 0 0 0 0 0 3.7320 -2.2754 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7320 -1.2754 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.6783 -0.9707 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.2619 -1.7754 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.8660 -2.7754 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.8660 -0.7754 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.9889 -3.5306 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0000 -2.2754 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0000 -1.2754 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.2136 1.7552 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.2566 1.3428 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.1921 1.9615 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.9244 0.5985 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.5458 2.4996 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.5673 2.2933 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.2781 1.1366 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.5028 2.9120 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.8600 1.2172 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.6138 -0.3520 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.1491 2.3739 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.4813 3.1182 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.8385 1.4234 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.8660 -3.3954 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.8660 -0.1554 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.3996 -3.7233 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.1815 -4.1200 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.5783 -3.3380 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.4631 -2.5854 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.4631 -0.9654 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.7384 3.0889 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.5719 -2.3123 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.1532 2.7548 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.0887 3.3735 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.6674 0.6278 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.0245 -0.1594 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.4212 -0.9413 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.2031 -0.5446 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 11.6739 3.7075 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 12.2525 0.9619 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1 13 1 0 0 0 0 1 40 1 0 0 0 0 2 25 2 0 0 0 0 3 9 1 0 0 0 0 4 9 2 0 0 0 0 5 10 1 0 0 0 0 5 13 1 0 0 0 0 5 16 1 0 0 0 0 6 8 2 0 0 0 0 6 12 1 0 0 0 0 7 19 2 0 0 0 0 7 22 1 0 0 0 0 8 25 1 0 0 0 0 9 29 1 0 0 0 0 10 11 1 0 0 0 0 10 14 2 0 0 0 0 11 12 1 0 0 0 0 11 15 2 0 0 0 0 12 13 2 0 0 0 0 14 17 1 0 0 0 0 14 32 1 0 0 0 0 15 18 1 0 0 0 0 15 33 1 0 0 0 0 16 34 1 0 0 0 0 16 35 1 0 0 0 0 16 36 1 0 0 0 0 17 18 2 0 0 0 0 17 37 1 0 0 0 0 18 38 1 0 0 0 0 19 21 1 0 0 0 0 19 23 1 0 0 0 0 20 22 2 0 0 0 0 20 24 1 0 0 0 0 20 25 1 0 0 0 0 21 26 2 0 0 0 0 21 27 1 0 0 0 0 22 28 1 0 0 0 0 23 24 2 0 0 0 0 23 39 1 0 0 0 0 24 41 1 0 0 0 0 26 30 1 0 0 0 0 26 42 1 0 0 0 0 27 31 2 0 0 0 0 27 43 1 0 0 0 0 28 44 1 0 0 0 0 28 45 1 0 0 0 0 28 46 1 0 0 0 0 29 30 2 0 0 0 0 29 31 1 0 0 0 0 30 47 1 0 0 0 0 31 48 1 0 0 0 0 M CHG 2 3 -1 9 1 M END $$$$