BQV6B2 -OEChem-04022107082D 41 44 0 0 0 0 0 0 0999 V2000 5.4641 1.2148 0.0000 S 0 0 0 0 0 0 0 0 0 0 0 0 4.5981 -6.2852 0.0000 F 0 0 0 0 0 0 0 0 0 0 0 0 6.2731 2.8026 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 4.6551 2.8026 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 4.9641 3.7536 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 7.7275 6.1807 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 2.0000 -2.7852 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 4.5981 -2.2852 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.5981 -0.2852 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.5981 -3.2852 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7320 -1.7852 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.4641 -1.7852 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7320 -0.7852 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.4641 -0.7852 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.5981 0.7148 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7320 -3.7852 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.4641 -3.7852 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7320 -4.7852 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.4641 -4.7852 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.5981 -5.2852 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.4641 2.2148 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.5519 4.5626 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.9641 3.7536 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.8660 -3.2852 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.1452 5.4762 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.5464 4.4581 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.7329 6.2852 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.1342 5.2671 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.1951 -2.0952 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.0010 -2.0952 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.1951 -0.4752 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.0010 -0.4752 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.3860 1.2974 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.9875 0.6071 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.0010 -3.4752 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.1951 -5.0952 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.0010 -5.0952 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.5286 5.5410 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.7986 3.8917 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.4808 6.8516 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.7508 5.2023 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1 15 1 0 0 0 0 1 21 1 0 0 0 0 2 20 1 0 0 0 0 3 21 1 0 0 0 0 3 23 1 0 0 0 0 4 5 1 0 0 0 0 4 21 2 0 0 0 0 5 23 2 0 0 0 0 6 27 2 0 0 0 0 6 28 1 0 0 0 0 7 24 3 0 0 0 0 8 10 1 0 0 0 0 8 11 2 0 0 0 0 8 12 1 0 0 0 0 9 13 2 0 0 0 0 9 14 1 0 0 0 0 9 15 1 0 0 0 0 10 16 2 0 0 0 0 10 17 1 0 0 0 0 11 13 1 0 0 0 0 11 29 1 0 0 0 0 12 14 2 0 0 0 0 12 30 1 0 0 0 0 13 31 1 0 0 0 0 14 32 1 0 0 0 0 15 33 1 0 0 0 0 15 34 1 0 0 0 0 16 18 1 0 0 0 0 16 24 1 0 0 0 0 17 19 2 0 0 0 0 17 35 1 0 0 0 0 18 20 2 0 0 0 0 18 36 1 0 0 0 0 19 20 1 0 0 0 0 19 37 1 0 0 0 0 22 23 1 0 0 0 0 22 25 2 0 0 0 0 22 26 1 0 0 0 0 25 27 1 0 0 0 0 25 38 1 0 0 0 0 26 28 2 0 0 0 0 26 39 1 0 0 0 0 27 40 1 0 0 0 0 28 41 1 0 0 0 0 M END $$$$