L6SMR3 -OEChem-05032300532D 89 93 0 1 0 0 0 0 0999 V2000 8.9282 -0.7500 0.0000 S 0 0 0 0 0 0 0 0 0 0 0 0 8.9282 4.2500 0.0000 S 0 0 0 0 0 0 0 0 0 0 0 0 2.0000 -6.7500 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 9.4282 -1.6160 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 8.4282 0.1160 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 9.4282 5.1160 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 8.4282 3.3840 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 6.3301 -4.2500 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 9.7942 -2.2500 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 9.7942 5.7500 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 5.4641 6.2500 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 3.7320 -5.7500 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 9.7942 -0.2500 0.0000 N 0 0 3 0 0 0 0 0 0 0 0 0 9.7942 3.7500 0.0000 N 0 0 3 0 0 0 0 0 0 0 0 0 5.4641 -2.7500 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 11.5263 -2.2500 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 11.5263 5.7500 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 3.7320 -6.7500 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.8660 -5.2500 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.5981 -5.2500 0.0000 C 0 0 0 0 0 0 0 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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 10.6603 -1.7500 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.6603 5.2500 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 8.0622 5.7500 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.3301 4.7500 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.1962 6.2500 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.3301 5.7500 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.4641 7.2500 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.9441 -7.3326 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.3426 -6.6423 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.2646 -4.7750 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.4675 -4.7750 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.8101 -5.8326 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.2087 -5.1423 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.4675 -7.7250 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.2646 -7.7250 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.7880 -5.1674 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.3894 -5.8577 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.3860 -3.6674 0.0000 H 0 0 0 0 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0 0 0 0 0 0 0 0 0 0 12.0632 -1.9400 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 11.5263 6.3700 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 12.0632 5.4400 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.0841 7.2500 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.4641 7.8700 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.8441 7.2500 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 13 1 0 0 0 0 1 31 1 0 0 0 0 2 6 2 0 0 0 0 2 7 2 0 0 0 0 2 14 1 0 0 0 0 2 36 1 0 0 0 0 3 24 1 0 0 0 0 3 25 1 0 0 0 0 8 35 2 0 0 0 0 9 44 2 0 0 0 0 10 45 2 0 0 0 0 11 50 1 0 0 0 0 11 51 1 0 0 0 0 12 18 1 0 0 0 0 12 19 1 0 0 0 0 12 20 1 0 0 0 0 13 21 1 0 0 0 0 13 30 1 0 0 0 0 14 23 1 0 0 0 0 14 32 1 0 0 0 0 15 35 1 0 0 0 0 15 39 1 0 0 0 0 15 76 1 0 0 0 0 16 44 1 0 0 0 0 16 83 1 0 0 0 0 16 84 1 0 0 0 0 17 45 1 0 0 0 0 17 85 1 0 0 0 0 17 86 1 0 0 0 0 18 24 1 0 0 0 0 18 52 1 0 0 0 0 18 53 1 0 0 0 0 19 25 1 0 0 0 0 19 54 1 0 0 0 0 19 55 1 0 0 0 0 20 27 1 0 0 0 0 20 56 1 0 0 0 0 20 57 1 0 0 0 0 21 22 1 0 0 0 0 21 28 2 0 0 0 0 22 26 1 0 0 0 0 22 33 2 0 0 0 0 23 26 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