B52SKF -OEChem-04012116012D 48 52 0 0 0 0 0 0 0999 V2000 9.8744 -2.6132 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 9.6015 0.7515 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 10.4580 -1.8085 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 11.1313 0.2515 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 2.8660 1.1915 0.0000 N 0 3 0 0 0 0 0 0 0 0 0 0 3.7320 0.6915 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.5981 0.1915 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.9282 -1.3085 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.1962 -1.3085 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.3301 -0.8085 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.9282 -2.3085 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.8744 -1.0038 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.0622 -0.8085 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.5981 -0.8085 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.4641 0.6915 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.1851 -0.0533 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.2320 -0.1745 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.2320 1.5575 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.4641 -1.3085 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.3301 0.1915 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.1962 -2.3085 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.0622 -2.8085 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.1851 1.5562 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.1356 1.2456 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.9789 2.5347 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.8799 1.9134 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.7232 3.2026 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.6737 2.8919 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0000 1.6915 0.0000 C 0 5 0 0 0 0 0 0 0 0 0 0 8.0622 -0.1885 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.0611 -1.1185 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.4641 1.3115 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.6951 0.1355 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.9220 -0.7115 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.7690 -0.4845 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.7690 1.2475 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.5420 2.0945 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.6951 1.8675 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.4641 -1.9285 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.8671 0.5015 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.6592 -2.6185 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.0622 -3.4285 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.0670 -3.2026 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.9815 0.7515 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.3895 2.7273 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 12.4692 1.7208 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.5953 3.8092 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 12.1352 3.3060 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1 3 1 0 0 0 0 1 11 1 0 0 0 0 1 43 1 0 0 0 0 2 16 1 0 0 0 0 2 23 1 0 0 0 0 2 44 1 0 0 0 0 3 12 2 0 0 0 0 4 16 2 0 0 0 0 4 24 1 0 0 0 0 5 6 1 0 0 0 0 5 29 3 0 0 0 0 6 7 1 0 0 0 0 6 17 1 0 0 0 0 6 18 1 0 0 0 0 7 14 2 0 0 0 0 7 15 1 0 0 0 0 8 11 2 0 0 0 0 8 12 1 0 0 0 0 8 13 1 0 0 0 0 9 10 1 0 0 0 0 9 13 2 0 0 0 0 9 21 1 0 0 0 0 10 19 2 0 0 0 0 10 20 1 0 0 0 0 11 22 1 0 0 0 0 12 16 1 0 0 0 0 13 30 1 0 0 0 0 14 19 1 0 0 0 0 14 31 1 0 0 0 0 15 20 2 0 0 0 0 15 32 1 0 0 0 0 17 33 1 0 0 0 0 17 34 1 0 0 0 0 17 35 1 0 0 0 0 18 36 1 0 0 0 0 18 37 1 0 0 0 0 18 38 1 0 0 0 0 19 39 1 0 0 0 0 20 40 1 0 0 0 0 21 22 2 0 0 0 0 21 41 1 0 0 0 0 22 42 1 0 0 0 0 23 24 1 0 0 0 0 23 25 2 0 0 0 0 24 26 2 0 0 0 0 25 27 1 0 0 0 0 25 45 1 0 0 0 0 26 28 1 0 0 0 0 26 46 1 0 0 0 0 27 28 2 0 0 0 0 27 47 1 0 0 0 0 28 48 1 0 0 0 0 M CHG 2 5 1 29 -1 M END $$$$