IBS-ZINC06624629 MOE2007 3D CORINA 3.40 0006 02.08.2006 47 51 0 0 0 0 0 0 0 0999 V2000 -0.3730 1.4300 -0.0090 C 0 0 0 0 0 0 0 0 0 0 0 0 0.2170 0.0470 -0.0910 C 0 0 0 0 0 0 0 0 0 0 0 0 0.8650 -0.4800 0.9620 C 0 0 0 0 0 0 0 0 0 0 0 0 0.1090 -0.6770 -1.4210 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.3220 -0.9280 -1.8820 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.9470 0.0310 -2.7320 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.2650 -0.1330 -3.1520 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.0200 -1.2300 -2.7440 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.4200 -2.1840 -1.9130 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.0840 -2.0720 -1.4780 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.8090 -3.2420 -0.6750 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.7160 -3.7810 0.0250 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.9200 -4.9890 0.6940 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.0830 -5.6830 0.7190 N 0 0 0 0 0 0 0 0 0 0 0 0 -3.1350 -5.1780 0.0420 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.9760 -3.9780 -0.6370 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.9420 -3.3470 -1.3760 N 0 0 0 0 0 0 0 0 0 0 0 0 -5.2190 -3.9330 -1.4720 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.0860 -3.3720 -2.1300 O 0 0 0 0 0 0 0 0 0 0 0 0 -5.4880 -5.2260 -0.7690 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.4430 -5.8300 -0.0220 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.7130 -7.0400 0.6290 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.9790 -7.6290 0.5400 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.9930 -7.0180 -0.2000 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.7520 -5.8130 -0.8580 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.1620 1.0970 -3.1080 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.7940 2.1990 -3.7720 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.7650 3.3280 -3.9350 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.6610 4.1150 -2.9500 O 0 0 0 0 0 0 0 0 0 0 0 0 0.0470 2.0690 -0.7910 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.4610 1.3980 -0.1200 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.1590 1.9100 0.9520 H 0 0 0 0 0 0 0 0 0 0 0 0 1.3410 -1.4520 0.9170 H 0 0 0 0 0 0 0 0 0 0 0 0 0.9500 0.0610 1.9000 H 0 0 0 0 0 0 0 0 0 0 0 0 0.6650 -0.1080 -2.1780 H 0 0 0 0 0 0 0 0 0 0 0 0 0.6350 -1.6370 -1.3850 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.7470 0.5860 -3.8080 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.0490 -1.3350 -3.0770 H 0 0 0 0 0 0 0 0 0 0 0 0 0.2540 -3.3050 0.0490 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.1080 -5.4490 1.2510 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.9370 -7.5330 1.2120 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.1730 -8.5690 1.0510 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.9730 -7.4840 -0.2630 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.5460 -5.3420 -1.4330 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.1450 1.8910 -4.7640 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.6350 2.5770 -3.1780 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.1670 3.3590 -5.0510 O 0 5 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 30 1 0 0 0 0 1 31 1 0 0 0 0 1 32 1 0 0 0 0 2 3 2 0 0 0 0 2 4 1 0 0 0 0 3 33 1 0 0 0 0 3 34 1 0 0 0 0 4 5 1 0 0 0 0 4 35 1 0 0 0 0 4 36 1 0 0 0 0 5 6 1 0 0 0 0 5 10 2 0 0 0 0 6 7 2 0 0 0 0 6 26 1 0 0 0 0 7 8 1 0 0 0 0 7 37 1 0 0 0 0 8 9 2 0 0 0 0 8 38 1 0 0 0 0 9 10 1 0 0 0 0 9 17 1 0 0 0 0 10 11 1 0 0 0 0 11 12 1 0 0 0 0 11 16 2 0 0 0 0 12 13 2 0 0 0 0 12 39 1 0 0 0 0 13 14 1 0 0 0 0 13 40 1 0 0 0 0 14 15 2 0 0 0 0 15 16 1 0 0 0 0 15 21 1 0 0 0 0 16 17 1 0 0 0 0 17 18 1 0 0 0 0 18 19 2 0 0 0 0 18 20 1 0 0 0 0 20 21 1 0 0 0 0 20 25 2 0 0 0 0 21 22 2 0 0 0 0 22 23 1 0 0 0 0 22 41 1 0 0 0 0 23 24 2 0 0 0 0 23 42 1 0 0 0 0 24 25 1 0 0 0 0 24 43 1 0 0 0 0 25 44 1 0 0 0 0 26 27 1 0 0 0 0 27 28 1 0 0 0 0 27 45 1 0 0 0 0 27 46 1 0 0 0 0 28 29 2 0 0 0 0 28 47 1 0 0 0 0 M CHG 1 47 -1 M END