IFLAB-ZINC04305647 MOE2007 3D CORINA 3.40 0006 02.08.2006 56 58 0 0 1 0 0 0 0 0999 V2000 0.3160 2.0220 -0.9840 C 0 0 0 0 0 0 0 0 0 0 0 0 0.1260 1.6130 1.3950 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.4740 3.7760 0.4870 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.4630 4.0740 1.6160 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.5030 5.5820 1.8720 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.4500 5.8680 2.9530 N 0 0 0 0 0 0 0 0 0 0 0 0 -2.6520 7.1400 3.3530 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.0490 8.0470 2.8180 O 0 0 0 0 0 0 0 0 0 0 0 0 -3.6170 7.4320 4.4560 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.2880 6.5370 4.9270 O 0 0 0 0 0 0 0 0 0 0 0 0 -3.7430 8.6880 4.9260 N 0 0 0 0 0 0 0 0 0 0 0 0 -4.6060 8.9560 6.0800 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.6830 10.4650 6.3200 C 0 0 3 0 0 0 0 0 0 0 0 0 -5.2370 10.6590 7.2380 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.3860 11.1230 5.1600 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.6660 11.5000 5.1500 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.0920 12.0850 3.9710 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.1590 12.1840 3.0230 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.6430 11.5180 3.6160 S 0 0 0 0 0 0 0 0 0 0 0 0 -3.3250 11.0110 6.4420 N 0 0 0 0 0 0 0 0 0 0 0 0 -3.3570 12.4810 6.6010 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.3120 12.6560 8.1370 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.6250 11.3870 8.6000 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.6660 10.4720 7.5540 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.0860 9.2170 7.7290 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.4860 8.8910 8.9280 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.4560 9.8060 9.9640 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.0270 11.0550 9.7970 C 0 0 0 0 0 0 0 0 0 0 0 0 0.3300 0.9440 -1.1420 H 0 0 0 0 0 0 0 0 0 0 0 0 1.3390 2.3870 -0.8840 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.1610 2.5080 -1.8340 H 0 0 0 0 0 0 0 0 0 0 0 0 1.1640 1.9120 1.5380 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0790 0.5390 1.2150 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.4490 1.8570 2.2880 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.7920 4.2900 -0.4200 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5190 4.1220 0.7720 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.4560 3.7280 1.3300 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.1450 3.5600 2.5230 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5100 5.9290 2.1570 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.8210 6.0970 0.9650 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.9310 5.1430 3.3810 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.2620 9.4160 4.5010 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.6050 8.5680 5.8830 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.1940 8.4680 6.9630 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.3190 11.3580 5.9990 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.1040 12.4350 3.8290 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.3110 12.6110 2.0420 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.4860 12.9400 6.1340 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.2790 12.8940 6.1920 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.7250 13.5340 8.4080 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.3190 12.7220 8.5480 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.1060 8.4980 6.9240 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0390 7.9160 9.0570 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9880 9.5460 10.9020 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.0030 11.7710 10.6050 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.4350 2.3280 0.2410 N 0 0 0 0 0 0 0 0 0 0 0 0 1 29 1 0 0 0 0 1 30 1 0 0 0 0 1 31 1 0 0 0 0 1 56 1 0 0 0 0 2 32 1 0 0 0 0 2 33 1 0 0 0 0 2 34 1 0 0 0 0 2 56 1 0 0 0 0 3 4 1 0 0 0 0 3 35 1 0 0 0 0 3 36 1 0 0 0 0 3 56 1 0 0 0 0 4 5 1 0 0 0 0 4 37 1 0 0 0 0 4 38 1 0 0 0 0 5 6 1 0 0 0 0 5 39 1 0 0 0 0 5 40 1 0 0 0 0 6 7 1 0 0 0 0 6 41 1 0 0 0 0 7 8 2 0 0 0 0 7 9 1 0 0 0 0 9 10 2 0 0 0 0 9 11 1 0 0 0 0 11 12 1 0 0 0 0 11 42 1 0 0 0 0 12 13 1 0 0 0 0 12 43 1 0 0 0 0 12 44 1 0 0 0 0 13 14 1 0 0 0 0 13 15 1 0 0 0 0 13 20 1 0 0 0 0 15 16 2 0 0 0 0 15 19 1 0 0 0 0 16 17 1 0 0 0 0 16 45 1 0 0 0 0 17 18 2 0 0 0 0 17 46 1 0 0 0 0 18 19 1 0 0 0 0 18 47 1 0 0 0 0 20 21 1 0 0 0 0 20 24 1 0 0 0 0 21 22 1 0 0 0 0 21 48 1 0 0 0 0 21 49 1 0 0 0 0 22 23 1 0 0 0 0 22 50 1 0 0 0 0 22 51 1 0 0 0 0 23 24 1 0 0 0 0 23 28 2 0 0 0 0 24 25 2 0 0 0 0 25 26 1 0 0 0 0 25 52 1 0 0 0 0 26 27 2 0 0 0 0 26 53 1 0 0 0 0 27 28 1 0 0 0 0 27 54 1 0 0 0 0 28 55 1 0 0 0 0 M END