BET27B -OEChem-04012116002D 39 41 0 0 0 0 0 0 0999 V2000 9.9939 1.0950 0.0000 Cl 0 0 0 0 0 0 0 0 0 0 0 0 7.9939 1.0950 0.0000 S 0 0 0 0 0 0 0 0 0 0 0 0 7.4939 -3.2351 0.0000 F 0 0 0 0 0 0 0 0 0 0 0 0 8.8600 -2.8691 0.0000 F 0 0 0 0 0 0 0 0 0 0 0 0 7.1279 -1.8691 0.0000 F 0 0 0 0 0 0 0 0 0 0 0 0 4.5981 0.0950 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 6.4103 1.8997 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 6.4103 0.2903 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 3.7320 1.5950 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 4.5981 3.0950 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 2.0000 -3.4050 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 4.5981 -0.9050 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.4641 0.5950 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7320 -1.4050 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.4641 1.5950 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7320 0.5950 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.9939 1.0950 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.5981 2.0950 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7320 -2.4050 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.4939 0.2290 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.9939 -0.6371 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.4939 -1.5031 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.4939 0.2290 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.4939 -1.5031 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.9939 -0.6371 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.8660 -2.9050 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.9939 -2.3691 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.8101 -1.4876 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.2087 -0.7973 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.5200 -0.8224 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.1215 -1.5127 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.6029 2.4891 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.1951 0.2850 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.9441 -2.9876 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.3426 -2.2973 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.3739 -0.6371 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.8039 -2.0400 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.6139 -0.6371 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.0611 3.4050 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1 23 1 0 0 0 0 2 17 1 0 0 0 0 2 20 1 0 0 0 0 3 27 1 0 0 0 0 4 27 1 0 0 0 0 5 27 1 0 0 0 0 6 12 1 0 0 0 0 6 13 1 0 0 0 0 6 16 1 0 0 0 0 7 15 1 0 0 0 0 7 17 1 0 0 0 0 7 32 1 0 0 0 0 8 13 1 0 0 0 0 8 17 2 0 0 0 0 9 16 2 0 0 0 0 9 18 1 0 0 0 0 10 18 2 0 0 0 0 10 39 1 0 0 0 0 11 26 3 0 0 0 0 12 14 1 0 0 0 0 12 28 1 0 0 0 0 12 29 1 0 0 0 0 13 15 2 0 0 0 0 14 19 1 0 0 0 0 14 30 1 0 0 0 0 14 31 1 0 0 0 0 15 18 1 0 0 0 0 16 33 1 0 0 0 0 19 26 1 0 0 0 0 19 34 1 0 0 0 0 19 35 1 0 0 0 0 20 21 1 0 0 0 0 20 23 2 0 0 0 0 21 22 2 0 0 0 0 21 36 1 0 0 0 0 22 24 1 0 0 0 0 22 27 1 0 0 0 0 23 25 1 0 0 0 0 24 25 2 0 0 0 0 24 37 1 0 0 0 0 25 38 1 0 0 0 0 M END $$$$