BQU3F1 -OEChem-04012114382D 52 53 0 1 0 0 0 0 0999 V2000 11.1972 0.7500 0.0000 S 0 0 0 0 0 0 0 0 0 0 0 0 13.7953 2.2500 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 10.6972 1.6160 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 11.6972 -0.1160 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 6.8671 0.2500 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 2.5369 -1.2500 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 3.4030 0.2500 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 12.0632 1.2500 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 7.7331 -1.2500 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 4.2690 -2.2500 0.0000 N 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 12.9292 0.7500 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.3312 0.2500 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.9292 2.7500 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 13.7953 1.2500 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 9.4651 -1.2500 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.5991 -0.7500 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 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 6.0010 -1.2500 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.1350 -0.7500 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 6.8671 -0.7500 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.2690 -1.2500 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 3.4030 -0.7500 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.8512 2.8326 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 11.4526 2.1423 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 12.5307 0.2751 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 13.3278 0.2751 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.1191 0.8326 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.7206 0.1423 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 13.3278 3.2250 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 12.5307 3.2250 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 14.0073 0.6674 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 14.4058 1.3577 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.9976 -0.2751 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.2006 -0.2751 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 7.7331 -1.8700 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.6025 -1.7250 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.3996 -1.7250 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.5335 -0.2751 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.7365 -0.2751 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 10.3312 -3.3700 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.8059 -1.5600 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.7320 -2.5600 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.8059 -2.5600 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.0000 -0.9400 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 8 1 0 0 0 0 1 13 1 0 0 0 0 2 14 1 0 0 0 0 2 15 1 0 0 0 0 5 25 2 0 0 0 0 6 27 1 0 0 0 0 6 52 1 0 0 0 0 7 27 2 0 0 0 0 8 11 1 0 0 0 0 8 12 1 0 0 0 0 9 18 1 0 0 0 0 9 25 1 0 0 0 0 9 42 1 0 0 0 0 26 10 1 6 0 0 0 10 50 1 0 0 0 0 10 51 1 0 0 0 0 11 14 1 0 0 0 0 11 28 1 0 0 0 0 11 29 1 0 0 0 0 12 15 1 0 0 0 0 12 30 1 0 0 0 0 12 31 1 0 0 0 0 13 16 1 0 0 0 0 13 32 1 0 0 0 0 13 33 1 0 0 0 0 14 34 1 0 0 0 0 14 35 1 0 0 0 0 15 36 1 0 0 0 0 15 37 1 0 0 0 0 16 17 1 0 0 0 0 16 19 2 0 0 0 0 17 18 1 0 0 0 0 17 20 2 0 0 0 0 18 38 1 0 0 0 0 18 39 1 0 0 0 0 19 21 1 0 0 0 0 19 40 1 0 0 0 0 20 24 1 0 0 0 0 20 41 1 0 0 0 0 21 24 2 0 0 0 0 21 47 1 0 0 0 0 22 23 1 0 0 0 0 22 25 1 0 0 0 0 22 43 1 0 0 0 0 22 44 1 0 0 0 0 23 26 1 0 0 0 0 23 45 1 0 0 0 0 23 46 1 0 0 0 0 24 48 1 0 0 0 0 26 27 1 0 0 0 0 26 49 1 0 0 0 0 M END $$$$