IFLAB-ZINC05299406 MOE2007 3D CORINA 3.40 0006 02.08.2006 42 45 0 0 0 0 0 0 0 0999 V2000 -0.0170 1.3750 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 1.2080 -0.6830 -0.0130 C 0 0 0 0 0 0 0 0 0 0 0 0 2.4020 0.0160 -0.0200 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3980 1.3960 -0.0130 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1850 2.0860 0.0020 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1720 3.5640 0.0100 C 0 0 0 0 0 0 0 0 0 0 0 0 0.1140 4.1630 0.0220 O 0 0 0 0 0 0 0 0 0 0 0 0 2.3340 4.2480 0.0020 N 0 0 0 0 0 0 0 0 0 0 0 0 2.3220 5.6350 0.0090 C 0 0 0 0 0 0 0 0 0 0 0 0 3.5370 6.3660 0.0020 C 0 0 0 0 0 0 0 0 0 0 0 0 4.9130 5.9050 -0.0140 C 0 0 0 0 0 0 0 0 0 0 0 0 5.8180 6.8650 -0.0170 C 0 0 0 0 0 0 0 0 0 0 0 0 5.0690 8.4500 -0.0020 S 0 0 0 0 0 0 0 0 0 0 0 0 3.4530 7.7620 0.0090 C 0 0 0 0 0 0 0 0 0 0 0 0 2.2460 8.3400 0.0240 N 0 0 0 0 0 0 0 0 0 0 0 0 1.1490 7.6190 0.0320 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1760 6.2980 0.0180 N 0 0 0 0 0 0 0 0 0 0 0 0 1.2230 -2.4440 -0.0210 S 0 0 0 0 0 0 0 0 0 0 0 0 2.4810 -2.8380 0.5090 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.0180 -2.8590 0.5330 O 0 0 0 0 0 0 0 0 0 0 0 0 1.2120 -2.9270 -1.6050 N 0 0 0 0 0 0 0 0 0 0 0 0 2.4010 -3.1670 -2.4360 C 0 0 0 0 0 0 0 0 0 0 0 0 1.9040 -3.5730 -3.8400 C 0 0 0 0 0 0 0 0 0 0 0 0 0.4660 -2.9910 -3.8820 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0080 -3.1940 -2.4140 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.9580 1.9040 0.0170 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9260 -0.5560 0.0080 H 0 0 0 0 0 0 0 0 0 0 0 0 3.3400 -0.5200 -0.0310 H 0 0 0 0 0 0 0 0 0 0 0 0 3.3300 1.9400 -0.0190 H 0 0 0 0 0 0 0 0 0 0 0 0 3.1780 3.7700 -0.0080 H 0 0 0 0 0 0 0 0 0 0 0 0 5.1750 4.8580 -0.0210 H 0 0 0 0 0 0 0 0 0 0 0 0 6.8840 6.6950 -0.0280 H 0 0 0 0 0 0 0 0 0 0 0 0 0.1940 8.1220 0.0440 H 0 0 0 0 0 0 0 0 0 0 0 0 2.9960 -2.2560 -2.5020 H 0 0 0 0 0 0 0 0 0 0 0 0 2.9970 -3.9720 -2.0070 H 0 0 0 0 0 0 0 0 0 0 0 0 2.5250 -3.1220 -4.6140 H 0 0 0 0 0 0 0 0 0 0 0 0 1.8840 -4.6580 -3.9430 H 0 0 0 0 0 0 0 0 0 0 0 0 0.4800 -1.9340 -4.1480 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.1640 -3.5560 -4.5680 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.3340 -4.2170 -2.2590 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.7820 -2.4870 -2.1620 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 19 1 0 0 0 0 4 5 2 0 0 0 0 4 29 1 0 0 0 0 5 6 1 0 0 0 0 5 30 1 0 0 0 0 6 7 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 18 2 0 0 0 0 11 12 1 0 0 0 0 11 15 2 0 0 0 0 12 13 2 0 0 0 0 12 32 1 0 0 0 0 13 14 1 0 0 0 0 13 33 1 0 0 0 0 14 15 1 0 0 0 0 15 16 1 0 0 0 0 16 17 2 0 0 0 0 17 18 1 0 0 0 0 17 34 1 0 0 0 0 19 20 2 0 0 0 0 19 21 2 0 0 0 0 19 22 1 0 0 0 0 22 23 1 0 0 0 0 22 26 1 0 0 0 0 23 24 1 0 0 0 0 23 35 1 0 0 0 0 23 36 1 0 0 0 0 24 25 1 0 0 0 0 24 37 1 0 0 0 0 24 38 1 0 0 0 0 25 26 1 0 0 0 0 25 39 1 0 0 0 0 25 40 1 0 0 0 0 26 41 1 0 0 0 0 26 42 1 0 0 0 0 M END