L8H2EJ -OEChem-05022323452D 49 52 0 1 0 0 0 0 0999 V2000 9.0084 0.1192 0.0000 S 0 0 0 0 0 0 0 0 0 0 0 0 7.1962 -1.0761 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 7.4179 -4.9239 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 4.5981 4.4239 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 2.8660 3.4239 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 5.8301 -4.1149 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 6.3301 0.4239 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 9.0084 1.7287 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 6.3301 -2.5761 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 6.3301 -1.5761 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 5.5211 -3.1639 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.1391 -3.1639 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.8301 -4.1149 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.4641 -1.0761 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.1962 -0.0761 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.0622 0.4239 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.0622 1.4239 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.3301 1.4239 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.1962 1.9239 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.4641 1.9239 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.4641 2.9239 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.5981 1.4239 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.5920 0.9239 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.5981 3.4239 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7320 1.9239 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7320 2.9239 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.4641 4.9239 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0000 2.9239 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.5728 -2.1902 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.8671 -1.8861 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.2111 -2.6269 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.9547 -3.4160 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.7055 -3.4160 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.4491 -2.6269 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.4657 -4.6165 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.7741 -0.5391 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.9272 -0.7661 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.1541 -1.6130 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.1962 2.5439 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.0010 3.2339 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.5981 0.8039 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.2120 0.9239 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.1951 1.6139 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.7741 4.3870 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.0010 5.2339 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.1541 5.4609 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.6900 3.4609 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.4631 2.6139 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.3100 2.3870 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1 16 1 0 0 0 0 1 23 1 0 0 0 0 10 2 1 1 0 0 0 2 15 1 0 0 0 0 3 13 2 0 0 0 0 4 24 1 0 0 0 0 4 27 1 0 0 0 0 5 26 1 0 0 0 0 5 28 1 0 0 0 0 6 11 1 0 0 0 0 6 13 1 0 0 0 0 6 35 1 0 0 0 0 7 15 1 0 0 0 0 7 18 2 0 0 0 0 8 17 1 0 0 0 0 8 23 2 0 0 0 0 9 10 1 0 0 0 0 9 11 1 0 0 0 0 9 12 1 0 0 0 0 9 29 1 1 0 0 0 10 14 1 0 0 0 0 10 30 1 0 0 0 0 11 31 1 0 0 0 0 11 32 1 0 0 0 0 12 13 1 0 0 0 0 12 33 1 0 0 0 0 12 34 1 0 0 0 0 14 36 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 16 17 1 0 0 0 0 17 19 2 0 0 0 0 18 19 1 0 0 0 0 18 20 1 0 0 0 0 19 39 1 0 0 0 0 20 21 2 0 0 0 0 20 22 1 0 0 0 0 21 24 1 0 0 0 0 21 40 1 0 0 0 0 22 25 2 0 0 0 0 22 41 1 0 0 0 0 23 42 1 0 0 0 0 24 26 2 0 0 0 0 25 26 1 0 0 0 0 25 43 1 0 0 0 0 27 44 1 0 0 0 0 27 45 1 0 0 0 0 27 46 1 0 0 0 0 28 47 1 0 0 0 0 28 48 1 0 0 0 0 28 49 1 0 0 0 0 M END $$$$