B1CR7I -OEChem-04022103062D 44 45 0 1 0 0 0 0 0999 V2000 11.5632 -1.6160 0.0000 F 0 0 0 0 0 0 0 0 0 0 0 0 12.9292 -1.2500 0.0000 F 0 0 0 0 0 0 0 0 0 0 0 0 12.5632 0.1160 0.0000 F 0 0 0 0 0 0 0 0 0 0 0 0 11.1972 3.7500 0.0000 F 0 0 0 0 0 0 0 0 0 0 0 0 12.0632 2.2500 0.0000 F 0 0 0 0 0 0 0 0 0 0 0 0 8.5991 1.2500 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 10.3312 2.2500 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 2.5369 -0.2500 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 3.4030 -1.7500 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 5.1350 -0.7500 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 6.0010 -0.2500 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.2690 -0.2500 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.0010 0.7500 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.8671 -0.7500 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.7331 0.7500 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.8671 1.2500 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.7331 -0.2500 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.4651 0.7500 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.3312 1.2500 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.1972 -0.2500 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.1350 -1.7500 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.1972 0.7500 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.4651 -0.2500 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.4030 -0.7500 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.3312 -0.7500 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.0632 -0.7500 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.1350 -2.7500 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.1972 2.7500 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.1350 -3.7500 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.1350 -0.1300 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.6675 0.2249 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.8705 0.2249 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.4641 1.0600 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.8671 -1.3700 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.8671 1.8700 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.2700 -0.5600 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 11.7341 1.0600 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.9282 -0.5600 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.3312 -1.3700 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.6603 3.0600 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.0000 -0.5600 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.5150 -3.7500 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.1350 -4.3700 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.7550 -3.7500 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1 26 1 0 0 0 0 2 26 1 0 0 0 0 3 26 1 0 0 0 0 4 28 1 0 0 0 0 5 28 1 0 0 0 0 6 15 1 0 0 0 0 6 18 1 0 0 0 0 7 19 1 0 0 0 0 7 28 1 0 0 0 0 8 24 1 0 0 0 0 8 41 1 0 0 0 0 9 24 2 0 0 0 0 10 11 1 0 0 0 0 10 12 1 0 0 0 0 10 21 1 0 0 0 0 10 30 1 0 0 0 0 11 13 2 0 0 0 0 11 14 1 0 0 0 0 12 24 1 0 0 0 0 12 31 1 0 0 0 0 12 32 1 0 0 0 0 13 16 1 0 0 0 0 13 33 1 0 0 0 0 14 17 2 0 0 0 0 14 34 1 0 0 0 0 15 16 2 0 0 0 0 15 17 1 0 0 0 0 16 35 1 0 0 0 0 17 36 1 0 0 0 0 18 19 2 0 0 0 0 18 23 1 0 0 0 0 19 22 1 0 0 0 0 20 22 2 0 0 0 0 20 25 1 0 0 0 0 20 26 1 0 0 0 0 21 27 3 0 0 0 0 22 37 1 0 0 0 0 23 25 2 0 0 0 0 23 38 1 0 0 0 0 25 39 1 0 0 0 0 27 29 1 0 0 0 0 28 40 1 0 0 0 0 29 42 1 0 0 0 0 29 43 1 0 0 0 0 29 44 1 0 0 0 0 M END $$$$