B6V7UT -OEChem-04022101192D 53 54 0 1 0 0 0 0 0999 V2000 2.8660 -1.0406 0.0000 S 0 0 0 0 0 0 0 0 0 0 0 0 3.7320 -2.5406 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 7.1962 -1.5406 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 5.4071 -4.6284 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 5.4641 -2.5406 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 6.3301 -0.0406 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 8.0622 4.9594 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 6.3301 4.9594 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 4.5981 -4.0406 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 3.7891 -4.6284 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.0981 -5.5794 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.0981 -5.5794 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.5981 -3.0406 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.4641 -1.5406 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 4.5981 -1.0406 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.3301 -1.0406 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7320 -1.5406 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.1962 0.4594 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.1962 1.4594 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.0622 1.9594 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.3301 1.9594 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0000 -1.5406 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.0622 2.9594 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.3301 2.9594 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.1962 3.4594 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.1962 4.4594 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.1505 -3.7591 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.4791 -4.0914 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.2227 -4.8805 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.4916 -5.7083 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.1629 -6.1960 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.0333 -6.1960 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.7045 -5.7083 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.9967 -4.4368 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.0010 -1.8506 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.0010 -2.8506 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.9966 -0.5656 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.1996 -0.5656 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.3335 -2.0155 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.1306 -2.0155 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.7932 0.2694 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.4082 -0.1232 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.8067 0.5671 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.5991 1.6494 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.7932 1.6494 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.6900 -1.0036 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.4631 -1.8506 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.3100 -2.0775 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.5991 3.2694 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.7932 3.2694 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.0622 5.5794 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.5991 4.6494 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.3301 5.5794 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1 17 1 0 0 0 0 1 22 1 0 0 0 0 2 13 2 0 0 0 0 3 16 2 0 0 0 0 4 9 1 0 0 0 0 4 12 1 0 0 0 0 4 34 1 0 0 0 0 5 13 1 0 0 0 0 14 5 1 1 0 0 0 5 36 1 0 0 0 0 6 16 1 0 0 0 0 6 18 1 0 0 0 0 6 41 1 0 0 0 0 7 26 1 0 0 0 0 7 51 1 0 0 0 0 7 52 1 0 0 0 0 8 26 2 0 0 0 0 8 53 1 0 0 0 0 9 10 1 0 0 0 0 9 13 1 6 0 0 0 9 27 1 0 0 0 0 10 11 1 0 0 0 0 10 28 1 0 0 0 0 10 29 1 0 0 0 0 11 12 1 0 0 0 0 11 30 1 0 0 0 0 11 31 1 0 0 0 0 12 32 1 0 0 0 0 12 33 1 0 0 0 0 14 15 1 0 0 0 0 14 16 1 0 0 0 0 14 35 1 0 0 0 0 15 17 1 0 0 0 0 15 37 1 0 0 0 0 15 38 1 0 0 0 0 17 39 1 0 0 0 0 17 40 1 0 0 0 0 18 19 1 0 0 0 0 18 42 1 0 0 0 0 18 43 1 0 0 0 0 19 20 2 0 0 0 0 19 21 1 0 0 0 0 20 23 1 0 0 0 0 20 44 1 0 0 0 0 21 24 2 0 0 0 0 21 45 1 0 0 0 0 22 46 1 0 0 0 0 22 47 1 0 0 0 0 22 48 1 0 0 0 0 23 25 2 0 0 0 0 23 49 1 0 0 0 0 24 25 1 0 0 0 0 24 50 1 0 0 0 0 25 26 1 0 0 0 0 M END $$$$