IFLAB-ZINC02457898 MOE2007 3D CORINA 3.40 0006 02.08.2006 47 50 0 0 0 0 0 0 0 0999 V2000 -0.0170 1.3890 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 1.1790 -0.6880 -0.0120 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3930 0.0160 -0.0200 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3750 1.4330 -0.0130 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1400 2.1060 0.0020 C 0 0 0 0 0 0 0 0 0 0 0 0 3.5890 2.1400 -0.0200 C 0 0 0 0 0 0 0 0 0 0 0 0 4.7700 1.4630 -0.0340 C 0 0 0 0 0 0 0 0 0 0 0 0 4.8010 0.0720 -0.0420 C 0 0 0 0 0 0 0 0 0 0 0 0 3.6320 -0.6590 -0.0350 C 0 0 0 0 0 0 0 0 0 0 0 0 3.6730 -2.0520 -0.0420 N 0 0 0 0 0 0 0 0 0 0 0 0 4.3850 -2.5630 1.1370 C 0 0 0 0 0 0 0 0 0 0 0 0 4.2530 -4.0890 1.1880 C 0 0 0 0 0 0 0 0 0 0 0 0 4.7050 -4.6400 -0.0990 N 0 0 0 0 0 0 0 0 0 0 0 0 4.1350 -4.0800 -1.3340 C 0 0 0 0 0 0 0 0 0 0 0 0 4.2720 -2.5540 -1.2860 C 0 0 0 0 0 0 0 0 0 0 0 0 5.8250 -5.8580 -0.1560 S 0 0 0 0 0 0 0 0 0 0 0 0 6.4380 -5.7800 -1.4360 O 0 0 0 0 0 0 0 0 0 0 0 0 6.5550 -5.7880 1.0610 O 0 0 0 0 0 0 0 0 0 0 0 0 4.9410 -7.3820 -0.1200 C 0 0 0 0 0 0 0 0 0 0 0 0 4.5390 -7.9740 -1.3030 C 0 0 0 0 0 0 0 0 0 0 0 0 3.8460 -9.1680 -1.2780 C 0 0 0 0 0 0 0 0 0 0 0 0 3.5530 -9.7750 -0.0630 C 0 0 0 0 0 0 0 0 0 0 0 0 3.9580 -9.1770 1.1240 C 0 0 0 0 0 0 0 0 0 0 0 0 4.6560 -7.9850 1.0910 C 0 0 0 0 0 0 0 0 0 0 0 0 2.8520 -10.9820 -0.0340 N 0 0 0 0 0 0 0 0 0 0 0 0 -0.9640 1.9080 0.0170 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9300 -0.5490 0.0080 H 0 0 0 0 0 0 0 0 0 0 0 0 1.1790 -1.7680 -0.0180 H 0 0 0 0 0 0 0 0 0 0 0 0 1.1110 3.1850 0.0080 H 0 0 0 0 0 0 0 0 0 0 0 0 3.5850 3.2200 -0.0150 H 0 0 0 0 0 0 0 0 0 0 0 0 5.6990 2.0150 -0.0400 H 0 0 0 0 0 0 0 0 0 0 0 0 5.7510 -0.4410 -0.0540 H 0 0 0 0 0 0 0 0 0 0 0 0 5.4390 -2.2910 1.0720 H 0 0 0 0 0 0 0 0 0 0 0 0 3.9530 -2.1300 2.0390 H 0 0 0 0 0 0 0 0 0 0 0 0 4.8730 -4.4840 1.9930 H 0 0 0 0 0 0 0 0 0 0 0 0 3.2110 -4.3600 1.3570 H 0 0 0 0 0 0 0 0 0 0 0 0 4.6770 -4.4690 -2.1960 H 0 0 0 0 0 0 0 0 0 0 0 0 3.0820 -4.3510 -1.4080 H 0 0 0 0 0 0 0 0 0 0 0 0 3.7580 -2.1150 -2.1400 H 0 0 0 0 0 0 0 0 0 0 0 0 5.3270 -2.2830 -1.3170 H 0 0 0 0 0 0 0 0 0 0 0 0 4.7670 -7.5020 -2.2470 H 0 0 0 0 0 0 0 0 0 0 0 0 3.5320 -9.6300 -2.2020 H 0 0 0 0 0 0 0 0 0 0 0 0 3.7320 -9.6450 2.0700 H 0 0 0 0 0 0 0 0 0 0 0 0 4.9760 -7.5220 2.0130 H 0 0 0 0 0 0 0 0 0 0 0 0 2.5690 -11.3990 -0.8630 H 0 0 0 0 0 0 0 0 0 0 0 0 2.6480 -11.4050 0.8150 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 1 0 0 0 0 4 10 2 0 0 0 0 5 6 1 0 0 0 0 5 7 2 0 0 0 0 6 30 1 0 0 0 0 7 8 1 0 0 0 0 7 31 1 0 0 0 0 8 9 2 0 0 0 0 8 32 1 0 0 0 0 9 10 1 0 0 0 0 9 33 1 0 0 0 0 10 11 1 0 0 0 0 11 12 1 0 0 0 0 11 16 1 0 0 0 0 12 13 1 0 0 0 0 12 34 1 0 0 0 0 12 35 1 0 0 0 0 13 14 1 0 0 0 0 13 36 1 0 0 0 0 13 37 1 0 0 0 0 14 15 1 0 0 0 0 14 17 1 0 0 0 0 15 16 1 0 0 0 0 15 38 1 0 0 0 0 15 39 1 0 0 0 0 16 40 1 0 0 0 0 16 41 1 0 0 0 0 17 18 2 0 0 0 0 17 19 2 0 0 0 0 17 20 1 0 0 0 0 20 21 1 0 0 0 0 20 25 2 0 0 0 0 21 22 2 0 0 0 0 21 42 1 0 0 0 0 22 23 1 0 0 0 0 22 43 1 0 0 0 0 23 24 2 0 0 0 0 23 26 1 0 0 0 0 24 25 1 0 0 0 0 24 44 1 0 0 0 0 25 45 1 0 0 0 0 26 46 1 0 0 0 0 26 47 1 0 0 0 0 M END