B2VGU9 -OEChem-04012115032D 57 59 0 0 0 0 0 0 0999 V2000 5.1350 2.2500 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 12.0632 0.2500 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 2.5369 1.7500 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 3.4030 3.2500 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 7.7331 0.7500 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 10.3312 0.2500 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 6.0010 1.7500 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.8671 2.2500 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.0010 0.7500 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.7331 1.7500 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.8671 0.2500 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.5991 0.2500 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.4651 0.7500 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.2690 1.7500 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.3312 -0.7500 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.1972 0.7500 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.4030 2.2500 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.4651 -1.2500 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.1972 -1.2500 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.1972 1.7500 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.4651 -2.2500 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.1972 -2.2500 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.3312 -2.7500 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.0632 2.2500 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.3312 2.2500 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.3312 -3.7500 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.0632 3.2500 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.3312 3.2500 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.1972 3.7500 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.4641 1.4400 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.2656 2.7250 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.4685 2.7250 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.3905 0.8577 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.7890 0.1674 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.3437 1.6423 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.9451 2.3326 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.4685 -0.2249 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.2656 -0.2249 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.2006 -0.2249 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.9976 -0.2249 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.8637 1.2250 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.0666 1.2250 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.8705 1.2750 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.6675 1.2750 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.9282 -0.9400 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 11.7341 -0.9400 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.9282 -2.5600 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 11.7341 -2.5600 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 12.6002 1.9400 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.7942 1.9400 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.7112 -3.7500 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.3312 -4.3700 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.9512 -3.7500 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.0000 2.0600 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 12.6002 3.5600 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.7942 3.5600 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 11.1972 4.3700 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1 7 1 0 0 0 0 1 14 1 0 0 0 0 2 16 2 0 0 0 0 3 17 1 0 0 0 0 3 54 1 0 0 0 0 4 17 2 0 0 0 0 5 10 1 0 0 0 0 5 11 1 0 0 0 0 5 12 1 0 0 0 0 6 13 1 0 0 0 0 6 15 1 0 0 0 0 6 16 1 0 0 0 0 7 8 1 0 0 0 0 7 9 1 0 0 0 0 7 30 1 0 0 0 0 8 10 1 0 0 0 0 8 31 1 0 0 0 0 8 32 1 0 0 0 0 9 11 1 0 0 0 0 9 33 1 0 0 0 0 9 34 1 0 0 0 0 10 35 1 0 0 0 0 10 36 1 0 0 0 0 11 37 1 0 0 0 0 11 38 1 0 0 0 0 12 13 1 0 0 0 0 12 39 1 0 0 0 0 12 40 1 0 0 0 0 13 41 1 0 0 0 0 13 42 1 0 0 0 0 14 17 1 0 0 0 0 14 43 1 0 0 0 0 14 44 1 0 0 0 0 15 18 2 0 0 0 0 15 19 1 0 0 0 0 16 20 1 0 0 0 0 18 21 1 0 0 0 0 18 45 1 0 0 0 0 19 22 2 0 0 0 0 19 46 1 0 0 0 0 20 24 2 0 0 0 0 20 25 1 0 0 0 0 21 23 2 0 0 0 0 21 47 1 0 0 0 0 22 23 1 0 0 0 0 22 48 1 0 0 0 0 23 26 1 0 0 0 0 24 27 1 0 0 0 0 24 49 1 0 0 0 0 25 28 2 0 0 0 0 25 50 1 0 0 0 0 26 51 1 0 0 0 0 26 52 1 0 0 0 0 26 53 1 0 0 0 0 27 29 2 0 0 0 0 27 55 1 0 0 0 0 28 29 1 0 0 0 0 28 56 1 0 0 0 0 29 57 1 0 0 0 0 M END $$$$