L5JBO2 -OEChem-05022323552D 45 47 0 1 0 0 0 0 0999 V2000 9.8744 -1.0107 0.0000 S 0 0 0 0 0 0 0 0 0 0 0 0 2.0000 -2.7060 0.0000 F 0 0 0 0 0 0 0 0 0 0 0 0 8.0622 1.7940 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 9.5172 2.2936 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 5.4641 -0.7060 0.0000 N 0 0 3 0 0 0 0 0 0 0 0 0 8.9282 0.2940 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 8.0622 -1.2060 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 11.1636 1.7555 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 6.3301 -1.2060 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.1962 -0.7060 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.4641 0.2940 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.9282 -0.7060 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.8744 0.5987 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.5981 -1.2060 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.1962 0.2940 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.0622 0.7940 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.4580 -0.2060 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.5981 0.7940 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.1851 1.5493 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.5981 -2.2060 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7320 -0.7060 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.4580 -0.2060 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7320 -2.7060 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.8660 -1.2060 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.8660 -2.2060 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.4743 2.7060 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.9316 -1.6809 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.7287 -1.6809 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.0747 0.1863 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.6762 0.8766 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.6592 0.6040 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.9081 1.3309 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.0611 1.1040 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.2881 0.2571 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.1350 -2.5160 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.7320 -0.0860 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 11.4580 -0.8260 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 12.0780 -0.2060 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 11.4580 0.4140 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.7320 -3.3260 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.3291 -0.8960 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 11.5777 1.2940 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 12.0636 2.5134 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 11.6669 3.2953 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.8849 2.8986 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1 12 1 0 0 0 0 1 17 1 0 0 0 0 2 25 1 0 0 0 0 3 16 2 0 0 0 0 4 19 2 0 0 0 0 5 9 1 0 0 0 0 5 11 1 0 0 0 0 5 14 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 10 1 0 0 0 0 7 12 2 0 0 0 0 8 19 1 0 0 0 0 8 26 1 0 0 0 0 8 42 1 0 0 0 0 9 10 1 0 0 0 0 9 27 1 0 0 0 0 9 28 1 0 0 0 0 10 15 2 0 0 0 0 11 18 1 0 0 0 0 11 29 1 0 0 0 0 11 30 1 0 0 0 0 13 17 2 0 0 0 0 13 19 1 0 0 0 0 14 20 2 0 0 0 0 14 21 1 0 0 0 0 15 16 1 0 0 0 0 15 31 1 0 0 0 0 17 22 1 0 0 0 0 18 32 1 0 0 0 0 18 33 1 0 0 0 0 18 34 1 0 0 0 0 20 23 1 0 0 0 0 20 35 1 0 0 0 0 21 24 2 0 0 0 0 21 36 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 25 2 0 0 0 0 23 40 1 0 0 0 0 24 25 1 0 0 0 0 24 41 1 0 0 0 0 26 43 1 0 0 0 0 26 44 1 0 0 0 0 26 45 1 0 0 0 0 M END $$$$