D0C7LS -OEChem-04152108422D 43 45 0 1 0 0 0 0 0999 V2000 9.8781 2.1170 0.0000 P 0 0 3 0 0 0 0 0 0 0 0 0 11.6010 2.2950 0.0000 P 0 0 0 0 0 0 0 0 0 0 0 0 7.3435 0.3525 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 4.8055 0.8569 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 6.0873 2.6148 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 9.0681 1.5306 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 10.6882 2.7034 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 10.4645 1.3069 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 9.2917 2.9270 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 4.2690 -3.7101 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 12.5138 1.8867 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 12.0093 3.2079 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 11.1927 1.3822 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 6.0812 -0.9054 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 6.0812 -2.5148 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 4.2690 -0.7101 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 3.4030 -2.2101 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 2.5369 -0.7101 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 5.8055 0.8552 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 6.3947 1.6632 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 6.3919 0.0452 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 7.3452 1.3525 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 8.1552 1.9389 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.1350 -1.2101 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.6648 -1.7101 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.1350 -2.2101 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.2690 -2.7101 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.4030 -1.2101 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.5231 0.3032 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.7825 1.7612 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.7794 -0.0508 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.8972 1.0701 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.5028 2.4523 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.7100 2.3704 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.4964 1.3944 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.5030 3.0748 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.2848 -1.7101 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.8660 -2.5201 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.2113 0.7410 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.0000 -1.0201 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.5369 -0.0901 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 13.0161 2.2503 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 11.6458 3.7101 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1 6 1 0 0 0 0 1 7 1 0 0 0 0 1 8 1 0 0 0 0 1 9 2 0 0 0 0 2 7 1 0 0 0 0 2 11 1 0 0 0 0 2 12 1 0 0 0 0 2 13 2 0 0 0 0 3 21 1 0 0 0 0 3 22 1 0 0 0 0 19 4 1 6 0 0 0 4 35 1 0 0 0 0 20 5 1 6 0 0 0 5 36 1 0 0 0 0 6 23 1 0 0 0 0 8 39 1 0 0 0 0 10 27 2 0 0 0 0 11 42 1 0 0 0 0 12 43 1 0 0 0 0 21 14 1 1 0 0 0 14 24 1 0 0 0 0 14 25 1 0 0 0 0 15 25 2 0 0 0 0 15 26 1 0 0 0 0 16 24 1 0 0 0 0 16 28 2 0 0 0 0 17 27 1 0 0 0 0 17 28 1 0 0 0 0 17 38 1 0 0 0 0 18 28 1 0 0 0 0 18 40 1 0 0 0 0 18 41 1 0 0 0 0 19 20 1 0 0 0 0 19 21 1 0 0 0 0 19 29 1 0 0 0 0 20 22 1 0 0 0 0 20 30 1 0 0 0 0 21 31 1 0 0 0 0 22 23 1 1 0 0 0 22 32 1 0 0 0 0 23 33 1 0 0 0 0 23 34 1 0 0 0 0 24 26 2 0 0 0 0 25 37 1 0 0 0 0 26 27 1 0 0 0 0 M END $$$$