BDW2H7 -OEChem-04012117092D 45 48 0 0 0 0 0 0 0999 V2000 7.1962 -2.9065 0.0000 S 0 0 0 0 0 0 0 0 0 0 0 0 4.5981 1.5935 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 2.8660 0.5935 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 10.2510 2.7003 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 8.0622 -1.4065 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 7.1962 -0.9065 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 9.5920 -1.9065 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 9.0084 -2.7112 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 6.3301 -1.4065 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.4641 -0.9065 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.3301 -2.4065 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.0084 -1.1018 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.0622 -2.4065 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.3191 -0.1513 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.4641 0.0935 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.5981 -1.4065 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.5981 0.5935 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7320 0.0935 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7320 -0.9065 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.6512 0.5930 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.2976 0.0550 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.9619 1.5436 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.6082 1.0055 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.9404 1.7498 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7320 2.0935 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0000 0.0935 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.2296 2.9065 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.7196 -2.2988 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.1181 -2.9891 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.0010 0.4035 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.5981 -2.0265 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.1951 -1.2165 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.0445 0.4652 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.7116 -0.4065 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.5478 2.0050 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 11.2149 1.1333 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.0420 2.6304 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.1951 2.4035 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.4220 1.5566 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.6900 0.6304 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.4631 -0.2165 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.3100 -0.4435 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 11.3574 2.2998 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 11.8362 3.0344 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 11.1017 3.5132 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1 11 1 0 0 0 0 1 13 1 0 0 0 0 2 17 1 0 0 0 0 2 25 1 0 0 0 0 3 18 1 0 0 0 0 3 26 1 0 0 0 0 4 24 1 0 0 0 0 4 27 1 0 0 0 0 5 6 1 0 0 0 0 5 12 1 0 0 0 0 5 13 1 0 0 0 0 6 9 2 0 0 0 0 7 8 1 0 0 0 0 7 12 2 0 0 0 0 8 13 2 0 0 0 0 9 10 1 0 0 0 0 9 11 1 0 0 0 0 10 15 2 0 0 0 0 10 16 1 0 0 0 0 11 28 1 0 0 0 0 11 29 1 0 0 0 0 12 14 1 0 0 0 0 14 20 2 0 0 0 0 14 21 1 0 0 0 0 15 17 1 0 0 0 0 15 30 1 0 0 0 0 16 19 2 0 0 0 0 16 31 1 0 0 0 0 17 18 2 0 0 0 0 18 19 1 0 0 0 0 19 32 1 0 0 0 0 20 22 1 0 0 0 0 20 33 1 0 0 0 0 21 23 2 0 0 0 0 21 34 1 0 0 0 0 22 24 2 0 0 0 0 22 35 1 0 0 0 0 23 24 1 0 0 0 0 23 36 1 0 0 0 0 25 37 1 0 0 0 0 25 38 1 0 0 0 0 25 39 1 0 0 0 0 26 40 1 0 0 0 0 26 41 1 0 0 0 0 26 42 1 0 0 0 0 27 43 1 0 0 0 0 27 44 1 0 0 0 0 27 45 1 0 0 0 0 M END $$$$