B3MJN7 -OEChem-04022107292D 50 51 0 0 0 0 0 0 0999 V2000 4.5981 4.7500 0.0000 S 0 0 0 0 0 0 0 0 0 0 0 0 7.1962 -0.7500 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 3.7320 0.2500 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 5.5981 4.7500 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 3.5981 4.7500 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 2.0000 3.2500 0.0000 O 0 5 0 0 0 0 0 0 0 0 0 0 2.8660 4.7500 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 5.4641 0.2500 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 6.3301 -2.2500 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 2.8660 3.7500 0.0000 N 0 3 0 0 0 0 0 0 0 0 0 0 5.4641 -0.7500 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.5981 3.7500 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.5981 1.7500 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.1962 -2.7500 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.3301 -1.2500 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.5981 0.7500 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7320 3.2500 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7320 2.2500 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.4641 3.2500 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.4641 2.2500 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.1962 -3.7500 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.3301 0.7500 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.4641 -2.7500 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.5981 5.7500 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.3301 -4.2500 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.0622 -4.2500 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.3301 -5.2500 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.0622 -5.2500 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.1962 -5.7500 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.8535 -0.6423 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.2520 -1.3326 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.8067 -2.8577 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.4082 -2.1674 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.1951 1.9400 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.0010 3.5600 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.0010 1.9400 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.6401 0.2131 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.8671 1.0600 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.0201 1.2869 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.1541 -2.2131 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.9272 -3.0600 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.7741 -3.2869 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.2181 5.7500 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.5981 6.3700 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.9781 5.7500 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.7932 -3.9400 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.5991 -3.9400 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.7932 -5.5600 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.5991 -5.5600 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.1962 -6.3700 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1 4 2 0 0 0 0 1 5 2 0 0 0 0 1 12 1 0 0 0 0 1 24 1 0 0 0 0 2 15 2 0 0 0 0 3 16 2 0 0 0 0 6 10 1 0 0 0 0 7 10 2 0 0 0 0 8 11 1 0 0 0 0 8 16 1 0 0 0 0 8 22 1 0 0 0 0 9 14 1 0 0 0 0 9 15 1 0 0 0 0 9 23 1 0 0 0 0 10 17 1 0 0 0 0 11 15 1 0 0 0 0 11 30 1 0 0 0 0 11 31 1 0 0 0 0 12 17 2 0 0 0 0 12 19 1 0 0 0 0 13 16 1 0 0 0 0 13 18 2 0 0 0 0 13 20 1 0 0 0 0 14 21 1 0 0 0 0 14 32 1 0 0 0 0 14 33 1 0 0 0 0 17 18 1 0 0 0 0 18 34 1 0 0 0 0 19 20 2 0 0 0 0 19 35 1 0 0 0 0 20 36 1 0 0 0 0 21 25 2 0 0 0 0 21 26 1 0 0 0 0 22 37 1 0 0 0 0 22 38 1 0 0 0 0 22 39 1 0 0 0 0 23 40 1 0 0 0 0 23 41 1 0 0 0 0 23 42 1 0 0 0 0 24 43 1 0 0 0 0 24 44 1 0 0 0 0 24 45 1 0 0 0 0 25 27 1 0 0 0 0 25 46 1 0 0 0 0 26 28 2 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 29 1 0 0 0 0 28 49 1 0 0 0 0 29 50 1 0 0 0 0 M CHG 2 6 -1 10 1 M END $$$$