BQB1U3 -OEChem-04012115072D 52 56 0 0 0 0 0 0 0999 V2000 5.4641 -4.0600 0.0000 F 0 0 0 0 0 0 0 0 0 0 0 0 10.3138 3.2490 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 4.5981 3.4400 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 5.4641 1.9400 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 6.3301 3.4400 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 7.1962 1.9400 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 6.3301 0.4400 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 8.1424 3.2447 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 8.1424 1.6353 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 3.7320 2.9400 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.8660 3.4400 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7320 1.9400 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0000 2.9400 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.8660 1.4400 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0000 1.9400 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.4641 2.9400 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.3301 1.4400 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.1962 2.9400 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.4641 -0.0600 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.7260 2.4400 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.4641 -1.0600 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.7260 2.4400 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.5981 -1.5600 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.3301 -1.5600 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.3138 1.6310 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.5981 -2.5600 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.3301 -2.5600 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.4641 -3.0600 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.2648 1.9400 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.2648 2.9400 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7320 3.5600 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.2646 3.9150 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.4675 3.9150 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.9441 1.3574 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.3426 2.0477 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.7880 3.5226 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.3894 2.8323 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.4675 0.9651 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.2646 0.9651 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.3894 2.0477 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.7880 1.3574 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.5981 4.0600 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.8671 0.1300 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.2520 0.5226 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.8535 -0.1677 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.0611 -1.2500 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.8671 -1.2500 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.1222 1.0413 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.0611 -2.8700 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.8671 -2.8700 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 11.7664 1.5756 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 11.7664 3.3044 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1 28 1 0 0 0 0 2 22 1 0 0 0 0 2 30 1 0 0 0 0 3 10 1 0 0 0 0 3 16 1 0 0 0 0 3 42 1 0 0 0 0 4 16 1 0 0 0 0 4 17 2 0 0 0 0 5 16 2 0 0 0 0 5 18 1 0 0 0 0 6 9 1 0 0 0 0 6 17 1 0 0 0 0 6 18 1 0 0 0 0 7 17 1 0 0 0 0 7 19 1 0 0 0 0 7 43 1 0 0 0 0 8 18 2 0 0 0 0 8 20 1 0 0 0 0 9 20 2 0 0 0 0 10 11 1 0 0 0 0 10 12 1 0 0 0 0 10 31 1 0 0 0 0 11 13 1 0 0 0 0 11 32 1 0 0 0 0 11 33 1 0 0 0 0 12 14 1 0 0 0 0 12 34 1 0 0 0 0 12 35 1 0 0 0 0 13 15 1 0 0 0 0 13 36 1 0 0 0 0 13 37 1 0 0 0 0 14 15 1 0 0 0 0 14 38 1 0 0 0 0 14 39 1 0 0 0 0 15 40 1 0 0 0 0 15 41 1 0 0 0 0 19 21 1 0 0 0 0 19 44 1 0 0 0 0 19 45 1 0 0 0 0 20 22 1 0 0 0 0 21 23 2 0 0 0 0 21 24 1 0 0 0 0 22 25 2 0 0 0 0 23 26 1 0 0 0 0 23 46 1 0 0 0 0 24 27 2 0 0 0 0 24 47 1 0 0 0 0 25 29 1 0 0 0 0 25 48 1 0 0 0 0 26 28 2 0 0 0 0 26 49 1 0 0 0 0 27 28 1 0 0 0 0 27 50 1 0 0 0 0 29 30 2 0 0 0 0 29 51 1 0 0 0 0 30 52 1 0 0 0 0 M END $$$$