B6PBS7 -OEChem-04012118332D 52 55 0 0 0 0 0 0 0999 V2000 2.8660 -0.6160 0.0000 S 0 0 0 0 0 0 0 0 0 0 0 0 11.4580 2.1160 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 2.3660 0.2500 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 3.3660 -1.4820 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 11.4580 0.3840 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 8.9282 -0.1160 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 9.8744 -0.4208 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 9.8744 1.1887 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 3.7320 -0.1160 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 12.9580 1.2500 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 13.4580 0.3840 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 13.4580 2.1160 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 14.4580 0.3840 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 14.4580 2.1160 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 14.9580 1.2500 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.9580 1.2500 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.4580 0.3840 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.9282 0.8840 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.1962 -0.1160 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.0622 -0.6160 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.0622 1.3840 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.3301 -0.6160 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.1962 0.8840 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.4641 -0.1160 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.5981 -0.6160 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.3301 -1.6160 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.5981 -1.6160 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.4641 -2.1160 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0000 -1.1160 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.6480 1.7869 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 12.8754 0.1719 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 13.5657 -0.2266 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 13.5657 2.7266 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 12.8754 2.3281 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 14.3504 -0.2266 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 15.0406 0.1719 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 15.0406 2.3281 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 14.3504 2.7266 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 15.4330 0.8515 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 15.4330 1.6485 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 11.7680 -0.1530 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.0622 -1.2360 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.0622 2.0040 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.6592 1.1940 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.4641 0.5040 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.8671 -1.9260 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.0611 -1.9260 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.4641 -2.7360 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.7320 0.5040 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.6900 -0.5791 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.4631 -1.4260 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.3100 -1.6530 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1 3 2 0 0 0 0 1 4 2 0 0 0 0 1 9 1 0 0 0 0 1 29 1 0 0 0 0 2 16 2 0 0 0 0 5 16 1 0 0 0 0 5 17 1 0 0 0 0 5 41 1 0 0 0 0 6 7 1 0 0 0 0 6 18 1 0 0 0 0 6 20 1 0 0 0 0 7 17 2 0 0 0 0 8 17 1 0 0 0 0 8 18 2 0 0 0 0 9 25 1 0 0 0 0 9 49 1 0 0 0 0 10 11 1 0 0 0 0 10 12 1 0 0 0 0 10 16 1 0 0 0 0 10 30 1 0 0 0 0 11 13 1 0 0 0 0 11 31 1 0 0 0 0 11 32 1 0 0 0 0 12 14 1 0 0 0 0 12 33 1 0 0 0 0 12 34 1 0 0 0 0 13 15 1 0 0 0 0 13 35 1 0 0 0 0 13 36 1 0 0 0 0 14 15 1 0 0 0 0 14 37 1 0 0 0 0 14 38 1 0 0 0 0 15 39 1 0 0 0 0 15 40 1 0 0 0 0 18 21 1 0 0 0 0 19 20 2 0 0 0 0 19 22 1 0 0 0 0 19 23 1 0 0 0 0 20 42 1 0 0 0 0 21 23 2 0 0 0 0 21 43 1 0 0 0 0 22 24 2 0 0 0 0 22 26 1 0 0 0 0 23 44 1 0 0 0 0 24 25 1 0 0 0 0 24 45 1 0 0 0 0 25 27 2 0 0 0 0 26 28 2 0 0 0 0 26 46 1 0 0 0 0 27 28 1 0 0 0 0 27 47 1 0 0 0 0 28 48 1 0 0 0 0 29 50 1 0 0 0 0 29 51 1 0 0 0 0 29 52 1 0 0 0 0 M END $$$$