IFLAB-ZINC04275541 MOE2007 3D CORINA 3.40 0006 02.08.2006 45 48 0 0 0 0 0 0 0 0999 V2000 -0.0720 1.2620 -0.1880 C 0 0 0 0 0 0 0 0 0 0 0 0 0.6080 1.0480 -1.3740 C 0 0 0 0 0 0 0 0 0 0 0 0 1.8240 0.3950 -1.3660 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3670 -0.0490 -0.1600 C 0 0 0 0 0 0 0 0 0 0 0 0 1.6760 0.1710 1.0320 C 0 0 0 0 0 0 0 0 0 0 0 0 0.4610 0.8240 1.0110 C 0 0 0 0 0 0 0 0 0 0 0 0 3.6700 -0.7500 -0.1450 C 0 0 0 0 0 0 0 0 0 0 0 0 4.7640 -0.2670 -0.9070 C 0 0 0 0 0 0 0 0 0 0 0 0 4.6670 0.8800 -1.7010 C 0 0 0 0 0 0 0 0 0 0 0 0 5.7520 1.2990 -2.4130 C 0 0 0 0 0 0 0 0 0 0 0 0 6.9550 0.6000 -2.3610 C 0 0 0 0 0 0 0 0 0 0 0 0 7.0830 -0.5220 -1.5980 C 0 0 0 0 0 0 0 0 0 0 0 0 5.9880 -0.9810 -0.8520 C 0 0 0 0 0 0 0 0 0 0 0 0 6.0620 -2.0770 -0.0860 N 0 0 0 0 0 0 0 0 0 0 0 0 5.0120 -2.4830 0.6040 C 0 0 0 0 0 0 0 0 0 0 0 0 3.8470 -1.8420 0.5860 N 0 0 0 0 0 0 0 0 0 0 0 0 5.1630 -3.9310 1.5960 S 0 0 0 0 0 0 0 0 0 0 0 0 6.8880 -4.3650 1.2590 C 0 0 0 0 0 0 0 0 0 0 0 0 7.2510 -5.6110 2.0250 C 0 0 0 0 0 0 0 0 0 0 0 0 6.4250 -6.1530 2.7290 O 0 0 0 0 0 0 0 0 0 0 0 0 8.4940 -6.1240 1.9270 N 0 0 0 0 0 0 0 0 0 0 0 0 8.8000 -7.3400 2.5480 C 0 0 0 0 0 0 0 0 0 0 0 0 7.8310 -8.3310 2.6520 C 0 0 0 0 0 0 0 0 0 0 0 0 8.1330 -9.5310 3.2650 C 0 0 0 0 0 0 0 0 0 0 0 0 9.3990 -9.7500 3.7750 C 0 0 0 0 0 0 0 0 0 0 0 0 10.3700 -8.7640 3.6750 C 0 0 0 0 0 0 0 0 0 0 0 0 10.0720 -7.5600 3.0550 C 0 0 0 0 0 0 0 0 0 0 0 0 11.6140 -8.9800 4.1780 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.0210 1.7770 -0.1990 H 0 0 0 0 0 0 0 0 0 0 0 0 0.1870 1.3920 -2.3070 H 0 0 0 0 0 0 0 0 0 0 0 0 2.3540 0.2280 -2.2920 H 0 0 0 0 0 0 0 0 0 0 0 0 2.0900 -0.1710 1.9690 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0750 0.9950 1.9330 H 0 0 0 0 0 0 0 0 0 0 0 0 3.7390 1.4310 -1.7500 H 0 0 0 0 0 0 0 0 0 0 0 0 5.6780 2.1850 -3.0260 H 0 0 0 0 0 0 0 0 0 0 0 0 7.8000 0.9520 -2.9350 H 0 0 0 0 0 0 0 0 0 0 0 0 8.0220 -1.0550 -1.5680 H 0 0 0 0 0 0 0 0 0 0 0 0 7.0150 -4.5440 0.1920 H 0 0 0 0 0 0 0 0 0 0 0 0 7.5360 -3.5460 1.5700 H 0 0 0 0 0 0 0 0 0 0 0 0 9.1760 -5.6500 1.4260 H 0 0 0 0 0 0 0 0 0 0 0 0 6.8410 -8.1620 2.2540 H 0 0 0 0 0 0 0 0 0 0 0 0 7.3790 -10.3000 3.3450 H 0 0 0 0 0 0 0 0 0 0 0 0 9.6320 -10.6900 4.2540 H 0 0 0 0 0 0 0 0 0 0 0 0 10.8280 -6.7930 2.9720 H 0 0 0 0 0 0 0 0 0 0 0 0 12.2300 -9.3750 3.5460 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 6 2 0 0 0 0 1 29 1 0 0 0 0 2 3 2 0 0 0 0 2 30 1 0 0 0 0 3 4 1 0 0 0 0 3 31 1 0 0 0 0 4 5 2 0 0 0 0 4 7 1 0 0 0 0 5 6 1 0 0 0 0 5 32 1 0 0 0 0 6 33 1 0 0 0 0 7 8 1 0 0 0 0 7 16 2 0 0 0 0 8 9 1 0 0 0 0 8 13 2 0 0 0 0 9 10 2 0 0 0 0 9 34 1 0 0 0 0 10 11 1 0 0 0 0 10 35 1 0 0 0 0 11 12 2 0 0 0 0 11 36 1 0 0 0 0 12 13 1 0 0 0 0 12 37 1 0 0 0 0 13 14 1 0 0 0 0 14 15 2 0 0 0 0 15 16 1 0 0 0 0 15 17 1 0 0 0 0 17 18 1 0 0 0 0 18 19 1 0 0 0 0 18 38 1 0 0 0 0 18 39 1 0 0 0 0 19 20 2 0 0 0 0 19 21 1 0 0 0 0 21 22 1 0 0 0 0 21 40 1 0 0 0 0 22 23 1 0 0 0 0 22 27 2 0 0 0 0 23 24 2 0 0 0 0 23 41 1 0 0 0 0 24 25 1 0 0 0 0 24 42 1 0 0 0 0 25 26 2 0 0 0 0 25 43 1 0 0 0 0 26 27 1 0 0 0 0 26 28 1 0 0 0 0 27 44 1 0 0 0 0 28 45 1 0 0 0 0 M END