IFLAB-ZINC04505177 MOE2007 3D CORINA 3.40 0006 02.08.2006 42 44 0 0 1 0 0 0 0 0999 V2000 -0.0540 1.3080 -0.6200 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0690 -0.1820 -0.2740 C 0 0 3 0 0 0 0 0 0 0 0 0 0.9220 -0.4570 0.8710 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1020 -1.9950 0.9420 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2260 -2.4650 -0.8260 S 0 0 0 0 0 0 0 0 0 0 0 0 0.4450 -3.6290 -1.0590 O 0 0 0 0 0 0 0 0 0 0 0 0 2.5890 -2.4340 -1.2270 O 0 0 0 0 0 0 0 0 0 0 0 0 0.3570 -1.0050 -1.5050 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.4180 -0.5790 0.1380 N 0 0 0 0 0 0 0 0 0 0 0 0 -1.6810 -1.9590 0.5520 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.6450 0.5330 0.1330 S 0 0 0 0 0 0 0 0 0 0 0 0 -3.6970 -0.0280 0.9080 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.0500 1.7890 0.4260 O 0 0 0 0 0 0 0 0 0 0 0 0 -3.2470 0.6400 -1.5190 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.1590 -0.3070 -1.9800 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.6430 -0.2540 -3.2520 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.2180 0.7710 -4.1140 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.6960 0.8600 -5.4330 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.2620 1.8660 -6.2400 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.3500 2.8130 -5.7790 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.8650 2.7590 -4.5080 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.2900 1.7340 -3.6450 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.8170 1.6490 -2.3250 C 0 0 0 0 0 0 0 0 0 0 0 0 0.8760 1.5520 -1.1330 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.8990 1.5380 -1.2700 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.1300 1.8950 0.2950 H 0 0 0 0 0 0 0 0 0 0 0 0 1.8790 0.0210 0.6590 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5180 -0.0840 1.8120 H 0 0 0 0 0 0 0 0 0 0 0 0 2.0170 -2.2540 1.4760 H 0 0 0 0 0 0 0 0 0 0 0 0 0.2360 -2.4650 1.4070 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5190 -1.3170 -2.0740 H 0 0 0 0 0 0 0 0 0 0 0 0 1.0310 -0.4240 -2.1350 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.5240 -2.0520 1.6270 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.7120 -2.2200 0.3120 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0040 -2.6320 0.0270 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.4870 -1.0960 -1.3190 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.3490 -0.9950 -3.5950 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.4030 0.1320 -5.8040 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.6300 1.9320 -7.2530 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.0220 3.6020 -6.4400 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.1580 3.4990 -4.1650 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.1130 2.3790 -1.9520 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 24 1 0 0 0 0 1 25 1 0 0 0 0 1 26 1 0 0 0 0 2 3 1 0 0 0 0 2 8 1 0 0 0 0 2 9 1 0 0 0 0 3 4 1 0 0 0 0 3 27 1 0 0 0 0 3 28 1 0 0 0 0 4 5 1 0 0 0 0 4 29 1 0 0 0 0 4 30 1 0 0 0 0 5 6 2 0 0 0 0 5 7 2 0 0 0 0 5 8 1 0 0 0 0 8 31 1 0 0 0 0 8 32 1 0 0 0 0 9 10 1 0 0 0 0 9 11 1 0 0 0 0 10 33 1 0 0 0 0 10 34 1 0 0 0 0 10 35 1 0 0 0 0 11 12 2 0 0 0 0 11 13 2 0 0 0 0 11 14 1 0 0 0 0 14 15 1 0 0 0 0 14 23 2 0 0 0 0 15 16 2 0 0 0 0 15 36 1 0 0 0 0 16 17 1 0 0 0 0 16 37 1 0 0 0 0 17 18 1 0 0 0 0 17 22 2 0 0 0 0 18 19 2 0 0 0 0 18 38 1 0 0 0 0 19 20 1 0 0 0 0 19 39 1 0 0 0 0 20 21 2 0 0 0 0 20 40 1 0 0 0 0 21 22 1 0 0 0 0 21 41 1 0 0 0 0 22 23 1 0 0 0 0 23 42 1 0 0 0 0 M END