IFLAB-ZINC04087105 MOE2007 3D CORINA 3.40 0006 02.08.2006 46 49 0 0 0 0 0 0 0 0999 V2000 0.1490 0.9160 0.1390 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0470 0.9870 2.6490 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.5010 1.8030 3.8330 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.9950 1.9640 3.7720 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.6640 1.7500 2.5790 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.3410 1.9170 2.7240 S 0 0 0 0 0 0 0 0 0 0 0 0 -4.2290 2.2700 4.3760 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.9140 2.3140 4.8370 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.6430 2.6420 6.2420 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.5110 2.5550 7.1100 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.3990 3.1130 6.5520 N 0 0 0 0 0 0 0 0 0 0 0 0 -5.3620 2.4760 5.1570 N 0 0 0 0 0 0 0 0 0 0 0 0 -6.6800 2.4830 4.7350 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.0980 2.4120 3.5860 O 0 0 0 0 0 0 0 0 0 0 0 0 -7.6850 2.6280 5.8230 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.4820 2.0810 7.0920 C 0 0 0 0 0 0 0 0 0 0 0 0 -8.4590 2.2340 8.0800 C 0 0 0 0 0 0 0 0 0 0 0 0 -9.6520 2.9250 7.8130 C 0 0 0 0 0 0 0 0 0 0 0 0 -10.6410 3.0850 8.7980 C 0 0 0 0 0 0 0 0 0 0 0 0 -11.8240 3.7690 8.5150 C 0 0 0 0 0 0 0 0 0 0 0 0 -12.0370 4.2990 7.2450 C 0 0 0 0 0 0 0 0 0 0 0 0 -11.0650 4.1480 6.2550 C 0 0 0 0 0 0 0 0 0 0 0 0 -9.8670 3.4650 6.5240 C 0 0 0 0 0 0 0 0 0 0 0 0 -8.8780 3.3050 5.5390 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.0350 1.3530 1.2860 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0120 -0.1650 0.1500 H 0 0 0 0 0 0 0 0 0 0 0 0 1.2150 1.1540 0.1940 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.2890 1.3690 -0.7540 H 0 0 0 0 0 0 0 0 0 0 0 0 1.1370 1.0760 2.5960 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.2300 -0.0710 2.7180 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.2080 1.3050 4.7640 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0410 2.7990 3.8210 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.6650 3.2890 5.8850 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.2060 3.3200 7.5250 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.1520 2.6380 6.1440 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.5890 1.5100 7.3330 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.2830 1.8010 9.0630 H 0 0 0 0 0 0 0 0 0 0 0 0 -10.4990 2.6770 9.7960 H 0 0 0 0 0 0 0 0 0 0 0 0 -12.5800 3.8860 9.2860 H 0 0 0 0 0 0 0 0 0 0 0 0 -12.9590 4.8300 7.0250 H 0 0 0 0 0 0 0 0 0 0 0 0 -11.2520 4.5680 5.2690 H 0 0 0 0 0 0 0 0 0 0 0 0 -9.0380 3.7120 4.5410 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.2390 0.2980 1.0700 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.3840 1.9760 0.4550 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5220 1.5150 1.3400 N 0 3 0 0 0 0 0 0 0 0 0 0 -0.3390 2.5270 1.3110 H 0 0 0 0 0 0 0 0 0 0 0 0 1 26 1 0 0 0 0 1 27 1 0 0 0 0 1 28 1 0 0 0 0 1 45 1 0 0 0 0 2 3 1 0 0 0 0 2 29 1 0 0 0 0 2 30 1 0 0 0 0 2 45 1 0 0 0 0 3 4 1 0 0 0 0 3 31 1 0 0 0 0 3 32 1 0 0 0 0 4 5 2 0 0 0 0 4 8 1 0 0 0 0 5 6 1 0 0 0 0 5 25 1 0 0 0 0 6 7 1 0 0 0 0 7 8 2 0 0 0 0 7 12 1 0 0 0 0 8 9 1 0 0 0 0 9 10 2 0 0 0 0 9 11 1 0 0 0 0 11 33 1 0 0 0 0 11 34 1 0 0 0 0 12 13 1 0 0 0 0 12 35 1 0 0 0 0 13 14 2 0 0 0 0 13 15 1 0 0 0 0 15 16 1 0 0 0 0 15 24 2 0 0 0 0 16 17 2 0 0 0 0 16 36 1 0 0 0 0 17 18 1 0 0 0 0 17 37 1 0 0 0 0 18 19 1 0 0 0 0 18 23 2 0 0 0 0 19 20 2 0 0 0 0 19 38 1 0 0 0 0 20 21 1 0 0 0 0 20 39 1 0 0 0 0 21 22 2 0 0 0 0 21 40 1 0 0 0 0 22 23 1 0 0 0 0 22 41 1 0 0 0 0 23 24 1 0 0 0 0 24 42 1 0 0 0 0 25 43 1 0 0 0 0 25 44 1 0 0 0 0 25 45 1 0 0 0 0 45 46 1 0 0 0 0 M CHG 1 45 1 M END