L0M4BU -OEChem-05022322402D 52 55 0 0 0 0 0 0 0999 V2000 8.9962 -1.2500 0.0000 S 0 0 0 0 0 0 0 0 0 0 0 0 8.4962 -2.1160 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 9.4962 -0.3840 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 8.1301 -0.7500 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 6.3981 0.2500 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 4.6660 0.2500 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 4.6660 2.2500 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 8.1301 0.2500 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.2641 -1.2500 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.2641 0.7500 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.3981 -0.7500 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.5321 0.7500 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.8622 -1.7500 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.5321 1.7500 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.3981 2.2500 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.8622 -2.7500 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.7282 -1.2500 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.8000 0.7500 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.8000 1.7500 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.7282 -3.2500 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.5942 -1.7500 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.3981 3.2500 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.5942 -2.7500 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.9061 0.2153 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.9061 2.2847 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0000 0.7292 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0000 1.7708 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.4603 -3.2500 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.7407 0.1423 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.3422 0.8326 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.8656 -1.7250 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.6626 -1.7250 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.6626 1.2250 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.8656 1.2250 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.7875 -0.6423 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.1860 -1.3326 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.6101 1.6674 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.0087 2.3577 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.3252 -3.0600 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.7282 -0.6300 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.7282 -3.8700 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 12.1312 -1.4400 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.0181 3.2500 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.3981 3.8700 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.7781 3.2500 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.9132 -0.4046 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.9132 2.9046 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.4643 0.4171 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.4643 2.0829 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 12.1503 -3.7869 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 12.9972 -3.5600 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 12.7703 -2.7131 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 2 0 0 0 0 1 3 2 0 0 0 0 1 4 1 0 0 0 0 1 13 1 0 0 0 0 4 8 1 0 0 0 0 4 9 1 0 0 0 0 5 10 1 0 0 0 0 5 11 1 0 0 0 0 5 12 1 0 0 0 0 6 12 2 0 0 0 0 6 18 1 0 0 0 0 7 14 2 0 0 0 0 7 19 1 0 0 0 0 8 10 1 0 0 0 0 8 29 1 0 0 0 0 8 30 1 0 0 0 0 9 11 1 0 0 0 0 9 31 1 0 0 0 0 9 32 1 0 0 0 0 10 33 1 0 0 0 0 10 34 1 0 0 0 0 11 35 1 0 0 0 0 11 36 1 0 0 0 0 12 14 1 0 0 0 0 13 16 2 0 0 0 0 13 17 1 0 0 0 0 14 15 1 0 0 0 0 15 22 1 0 0 0 0 15 37 1 0 0 0 0 15 38 1 0 0 0 0 16 20 1 0 0 0 0 16 39 1 0 0 0 0 17 21 2 0 0 0 0 17 40 1 0 0 0 0 18 19 1 0 0 0 0 18 24 2 0 0 0 0 19 25 2 0 0 0 0 20 23 2 0 0 0 0 20 41 1 0 0 0 0 21 23 1 0 0 0 0 21 42 1 0 0 0 0 22 43 1 0 0 0 0 22 44 1 0 0 0 0 22 45 1 0 0 0 0 23 28 1 0 0 0 0 24 26 1 0 0 0 0 24 46 1 0 0 0 0 25 27 1 0 0 0 0 25 47 1 0 0 0 0 26 27 2 0 0 0 0 26 48 1 0 0 0 0 27 49 1 0 0 0 0 28 50 1 0 0 0 0 28 51 1 0 0 0 0 28 52 1 0 0 0 0 M END $$$$