B2S1FT -OEChem-04012114462D 43 44 0 0 0 0 0 0 0999 V2000 11.1972 -2.9050 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 7.7331 0.0950 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 4.2690 4.0950 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 2.5369 3.0950 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 7.7331 -1.9050 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 9.4651 -2.9050 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 6.0010 0.0950 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 7.7331 -2.9050 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.5991 -1.4050 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.5991 -3.4050 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.4651 -1.9050 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.8671 -1.4050 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.3312 -3.4050 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.8671 -0.4050 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.3312 -4.4050 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.0010 1.0950 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.1350 1.5950 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.1350 2.5950 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.2690 1.0950 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.2690 3.0950 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.4030 1.5950 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.4030 2.5950 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.1225 -2.7973 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.5210 -3.4876 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.9976 -0.9301 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.2006 -0.9301 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.2006 -3.8800 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.9976 -3.8800 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.0757 -2.0127 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.6772 -1.3224 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.2565 -1.2973 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.6550 -1.9876 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.4641 -0.2150 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.7112 -4.4050 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.3312 -5.0250 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.9512 -4.4050 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.6116 0.9873 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.2131 1.6776 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.6720 2.9050 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.2690 0.4750 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.8660 1.2850 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.8059 4.4050 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.0000 2.7850 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1 13 2 0 0 0 0 2 14 2 0 0 0 0 3 20 1 0 0 0 0 3 42 1 0 0 0 0 4 22 1 0 0 0 0 4 43 1 0 0 0 0 5 8 1 0 0 0 0 5 9 1 0 0 0 0 5 12 1 0 0 0 0 6 10 1 0 0 0 0 6 11 1 0 0 0 0 6 13 1 0 0 0 0 7 14 1 0 0 0 0 7 16 1 0 0 0 0 7 33 1 0 0 0 0 8 10 1 0 0 0 0 8 23 1 0 0 0 0 8 24 1 0 0 0 0 9 11 1 0 0 0 0 9 25 1 0 0 0 0 9 26 1 0 0 0 0 10 27 1 0 0 0 0 10 28 1 0 0 0 0 11 29 1 0 0 0 0 11 30 1 0 0 0 0 12 14 1 0 0 0 0 12 31 1 0 0 0 0 12 32 1 0 0 0 0 13 15 1 0 0 0 0 15 34 1 0 0 0 0 15 35 1 0 0 0 0 15 36 1 0 0 0 0 16 17 1 0 0 0 0 16 37 1 0 0 0 0 16 38 1 0 0 0 0 17 18 2 0 0 0 0 17 19 1 0 0 0 0 18 20 1 0 0 0 0 18 39 1 0 0 0 0 19 21 2 0 0 0 0 19 40 1 0 0 0 0 20 22 2 0 0 0 0 21 22 1 0 0 0 0 21 41 1 0 0 0 0 M END $$$$