IFLAB-ZINC04315800 MOE2007 3D CORINA 3.40 0006 02.08.2006 40 42 0 0 0 0 0 0 0 0999 V2000 -0.0170 1.3800 0.0100 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0020 -0.0040 0.0020 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2050 -0.6860 -0.0130 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3970 0.0120 -0.0210 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3850 1.4090 -0.0130 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1660 2.0890 0.0020 C 0 0 0 0 0 0 0 0 0 0 0 0 3.6560 2.1630 -0.0210 C 0 0 0 0 0 0 0 0 0 0 0 0 4.7160 1.5670 -0.0340 O 0 0 0 0 0 0 0 0 0 0 0 0 3.6400 3.5100 -0.0140 N 0 0 0 0 0 0 0 0 0 0 0 0 4.9000 4.2580 -0.0210 C 0 0 0 0 0 0 0 0 0 0 0 0 4.6030 5.7580 -0.0100 C 0 0 0 0 0 0 0 0 0 0 0 0 6.1600 6.6820 -0.0200 S 0 0 0 0 0 0 0 0 0 0 0 0 5.5380 8.3300 -0.0050 C 0 0 0 0 0 0 0 0 0 0 0 0 6.2920 9.4640 -0.0060 N 0 0 0 0 0 0 0 0 0 0 0 0 7.2610 9.5130 -0.0150 H 0 0 0 0 0 0 0 0 0 0 0 0 5.4130 10.5320 0.0080 C 0 0 0 0 0 0 0 0 0 0 0 0 4.1610 10.0050 0.0170 C 0 0 0 0 0 0 0 0 0 0 0 0 4.2680 8.6700 0.0030 N 0 0 0 0 0 0 0 0 0 0 0 0 5.7670 11.9670 0.0120 C 0 0 0 0 0 0 0 0 0 0 0 0 4.7620 12.9370 0.0270 C 0 0 0 0 0 0 0 0 0 0 0 0 5.0990 14.2740 0.0310 C 0 0 0 0 0 0 0 0 0 0 0 0 6.4300 14.6560 0.0210 C 0 0 0 0 0 0 0 0 0 0 0 0 7.4310 13.7000 0.0060 C 0 0 0 0 0 0 0 0 0 0 0 0 7.1070 12.3590 0.0080 C 0 0 0 0 0 0 0 0 0 0 0 0 6.8450 16.3420 0.0260 Cl 0 0 0 0 0 0 0 0 0 0 0 0 3.9070 -0.8450 -0.0390 Cl 0 0 0 0 0 0 0 0 0 0 0 0 -0.9600 1.9060 0.0170 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9270 -0.5540 0.0080 H 0 0 0 0 0 0 0 0 0 0 0 0 1.2120 -1.7660 -0.0190 H 0 0 0 0 0 0 0 0 0 0 0 0 1.1490 3.1690 0.0080 H 0 0 0 0 0 0 0 0 0 0 0 0 2.7940 3.9850 -0.0030 H 0 0 0 0 0 0 0 0 0 0 0 0 5.4830 3.9960 0.8620 H 0 0 0 0 0 0 0 0 0 0 0 0 5.4660 4.0060 -0.9180 H 0 0 0 0 0 0 0 0 0 0 0 0 4.0200 6.0200 -0.8940 H 0 0 0 0 0 0 0 0 0 0 0 0 4.0360 6.0100 0.8860 H 0 0 0 0 0 0 0 0 0 0 0 0 3.2380 10.5660 0.0280 H 0 0 0 0 0 0 0 0 0 0 0 0 3.7240 12.6400 0.0340 H 0 0 0 0 0 0 0 0 0 0 0 0 4.3230 15.0250 0.0420 H 0 0 0 0 0 0 0 0 0 0 0 0 8.4670 14.0040 -0.0020 H 0 0 0 0 0 0 0 0 0 0 0 0 7.8880 11.6130 0.0020 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 27 1 0 0 0 0 2 3 2 0 0 0 0 2 28 1 0 0 0 0 3 4 1 0 0 0 0 3 29 1 0 0 0 0 4 5 2 0 0 0 0 4 26 1 0 0 0 0 5 6 1 0 0 0 0 5 7 1 0 0 0 0 6 30 1 0 0 0 0 7 8 2 0 0 0 0 7 9 1 0 0 0 0 9 10 1 0 0 0 0 9 31 1 0 0 0 0 10 11 1 0 0 0 0 10 32 1 0 0 0 0 10 33 1 0 0 0 0 11 12 1 0 0 0 0 11 34 1 0 0 0 0 11 35 1 0 0 0 0 12 13 1 0 0 0 0 13 14 1 0 0 0 0 13 18 2 0 0 0 0 14 15 1 0 0 0 0 14 16 1 0 0 0 0 16 17 2 0 0 0 0 16 19 1 0 0 0 0 17 18 1 0 0 0 0 17 36 1 0 0 0 0 19 20 1 0 0 0 0 19 24 2 0 0 0 0 20 21 2 0 0 0 0 20 37 1 0 0 0 0 21 22 1 0 0 0 0 21 38 1 0 0 0 0 22 23 2 0 0 0 0 22 25 1 0 0 0 0 23 24 1 0 0 0 0 23 39 1 0 0 0 0 24 40 1 0 0 0 0 M END