L3LQK8 -OEChem-05022323362D 42 43 0 1 0 0 0 0 0999 V2000 7.6962 3.3840 0.0000 F 0 0 0 0 0 0 0 0 0 0 0 0 8.0622 4.7500 0.0000 F 0 0 0 0 0 0 0 0 0 0 0 0 6.6962 5.1160 0.0000 F 0 0 0 0 0 0 0 0 0 0 0 0 2.0000 -2.7500 0.0000 F 0 0 0 0 0 0 0 0 0 0 0 0 5.4641 -2.7500 0.0000 F 0 0 0 0 0 0 0 0 0 0 0 0 5.4641 -4.7500 0.0000 F 0 0 0 0 0 0 0 0 0 0 0 0 2.0000 -4.7500 0.0000 F 0 0 0 0 0 0 0 0 0 0 0 0 3.7320 -5.7500 0.0000 F 0 0 0 0 0 0 0 0 0 0 0 0 3.7320 -1.7500 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 5.5981 -0.2500 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 3.7320 1.2500 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 4.5981 5.7500 0.0000 O 0 5 0 0 0 0 0 0 0 0 0 0 6.3301 5.7500 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 5.4641 1.2500 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 5.4641 5.2500 0.0000 N 0 3 0 0 0 0 0 0 0 0 0 0 4.5981 -0.2500 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 4.5981 -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 3.5981 -0.2500 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 6.3301 2.7500 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.3301 3.7500 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.5981 2.7500 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7320 -2.7500 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.4641 4.2500 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 7.1962 4.2500 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.8660 -3.2500 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.5981 -3.2500 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.5981 -4.2500 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.8660 -4.2500 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7320 -4.7500 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.8101 -1.8326 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.2087 -1.1423 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.5981 0.3700 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.9781 -0.2500 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.5981 -0.8700 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.0010 0.9400 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.9081 -0.7869 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.8671 2.4400 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.0611 2.4400 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.0611 4.0600 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1 27 1 0 0 0 0 2 27 1 0 0 0 0 3 27 1 0 0 0 0 4 28 1 0 0 0 0 5 29 1 0 0 0 0 6 30 1 0 0 0 0 7 31 1 0 0 0 0 8 32 1 0 0 0 0 9 17 1 0 0 0 0 9 24 1 0 0 0 0 16 10 1 6 0 0 0 10 39 1 0 0 0 0 11 18 2 0 0 0 0 12 15 1 0 0 0 0 13 15 2 0 0 0 0 14 18 1 0 0 0 0 14 20 1 0 0 0 0 14 38 1 0 0 0 0 15 25 1 0 0 0 0 16 17 1 0 0 0 0 16 18 1 0 0 0 0 16 19 1 0 0 0 0 17 33 1 0 0 0 0 17 34 1 0 0 0 0 19 35 1 0 0 0 0 19 36 1 0 0 0 0 19 37 1 0 0 0 0 20 21 2 0 0 0 0 20 23 1 0 0 0 0 21 22 1 0 0 0 0 21 40 1 0 0 0 0 22 25 2 0 0 0 0 22 27 1 0 0 0 0 23 26 2 0 0 0 0 23 41 1 0 0 0 0 24 28 2 0 0 0 0 24 29 1 0 0 0 0 25 26 1 0 0 0 0 26 42 1 0 0 0 0 28 31 1 0 0 0 0 29 30 2 0 0 0 0 30 32 1 0 0 0 0 31 32 2 0 0 0 0 M CHG 2 12 -1 15 1 M END $$$$