IFLAB-ZINC04497465 MOE2007 3D CORINA 3.40 0006 02.08.2006 40 42 0 0 1 0 0 0 0 0999 V2000 -0.0160 1.3770 0.0260 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0020 -0.0040 0.0180 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2090 -0.6810 -0.0130 C 0 0 0 0 0 0 0 0 0 0 0 0 2.4000 0.0240 -0.0370 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3870 1.4050 -0.0290 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1770 2.0860 0.0020 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1610 3.4860 0.0100 N 0 0 0 0 0 0 0 0 0 0 0 0 2.3590 4.3270 0.1080 C 0 0 0 0 0 0 0 0 0 0 0 0 1.8480 5.7270 0.5140 C 0 0 3 0 0 0 0 0 0 0 0 0 2.4310 6.5110 0.0310 H 0 0 0 0 0 0 0 0 0 0 0 0 0.3990 5.7020 -0.0250 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0460 4.2320 -0.0780 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.0790 3.7910 -0.1820 O 0 0 0 0 0 0 0 0 0 0 0 0 1.8630 5.8890 1.9700 N 0 0 0 0 0 0 0 0 0 0 0 0 1.9510 7.1200 2.5110 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0170 8.0950 1.7920 O 0 0 0 0 0 0 0 0 0 0 0 0 1.9660 7.2870 4.0090 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0720 8.7790 4.3850 C 0 0 0 0 0 0 0 0 0 0 0 0 2.9850 8.8570 5.6210 C 0 0 0 0 0 0 0 0 0 0 0 0 3.4020 7.4090 5.9530 C 0 0 0 0 0 0 0 0 0 0 0 0 3.2440 6.6510 4.6110 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2290 -2.4170 -0.0230 Cl 0 0 0 0 0 0 0 0 0 0 0 0 -0.9580 1.9040 0.0460 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9260 -0.5560 0.0370 H 0 0 0 0 0 0 0 0 0 0 0 0 3.3400 -0.5070 -0.0610 H 0 0 0 0 0 0 0 0 0 0 0 0 3.3160 1.9540 -0.0460 H 0 0 0 0 0 0 0 0 0 0 0 0 3.0330 3.9360 0.8710 H 0 0 0 0 0 0 0 0 0 0 0 0 2.8660 4.3760 -0.8550 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.2700 6.2340 0.6520 H 0 0 0 0 0 0 0 0 0 0 0 0 0.3560 6.1370 -1.0240 H 0 0 0 0 0 0 0 0 0 0 0 0 1.8090 5.1100 2.5460 H 0 0 0 0 0 0 0 0 0 0 0 0 1.0730 6.8440 4.4500 H 0 0 0 0 0 0 0 0 0 0 0 0 2.5110 9.3420 3.5610 H 0 0 0 0 0 0 0 0 0 0 0 0 1.0850 9.1750 4.6240 H 0 0 0 0 0 0 0 0 0 0 0 0 3.8660 9.4570 5.3970 H 0 0 0 0 0 0 0 0 0 0 0 0 2.4410 9.2900 6.4600 H 0 0 0 0 0 0 0 0 0 0 0 0 4.4380 7.3780 6.2890 H 0 0 0 0 0 0 0 0 0 0 0 0 2.7420 6.9860 6.7100 H 0 0 0 0 0 0 0 0 0 0 0 0 3.1000 5.5850 4.7850 H 0 0 0 0 0 0 0 0 0 0 0 0 4.1040 6.8260 3.9650 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 23 1 0 0 0 0 2 3 2 0 0 0 0 2 24 1 0 0 0 0 3 4 1 0 0 0 0 3 22 1 0 0 0 0 4 5 2 0 0 0 0 4 25 1 0 0 0 0 5 6 1 0 0 0 0 5 26 1 0 0 0 0 6 7 1 0 0 0 0 7 8 1 0 0 0 0 7 12 1 0 0 0 0 8 9 1 0 0 0 0 8 27 1 0 0 0 0 8 28 1 0 0 0 0 9 10 1 0 0 0 0 9 11 1 0 0 0 0 9 14 1 0 0 0 0 11 12 1 0 0 0 0 11 29 1 0 0 0 0 11 30 1 0 0 0 0 12 13 2 0 0 0 0 14 15 1 0 0 0 0 14 31 1 0 0 0 0 15 16 2 0 0 0 0 15 17 1 0 0 0 0 17 18 1 0 0 0 0 17 21 1 0 0 0 0 17 32 1 0 0 0 0 18 19 1 0 0 0 0 18 33 1 0 0 0 0 18 34 1 0 0 0 0 19 20 1 0 0 0 0 19 35 1 0 0 0 0 19 36 1 0 0 0 0 20 21 1 0 0 0 0 20 37 1 0 0 0 0 20 38 1 0 0 0 0 21 39 1 0 0 0 0 21 40 1 0 0 0 0 M END