IFLAB-ZINC04075949 MOE2007 3D CORINA 3.40 0006 02.08.2006 41 43 0 0 1 0 0 0 0 0999 V2000 -0.0160 1.3060 0.0090 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 -1.2930 -0.7750 0.0100 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.3180 -1.7000 -1.1260 N 0 0 0 0 0 0 0 0 0 0 0 0 -0.8420 -2.9250 -0.9870 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.3750 -3.3370 0.0540 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.9310 -3.7700 -2.2370 C 0 0 3 0 0 0 0 0 0 0 0 0 -1.5600 -4.6440 -2.0660 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.7020 -2.6520 -3.4540 S 0 0 0 0 0 0 0 0 0 0 0 0 -1.8390 -1.2920 -2.3240 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.3450 -0.1070 -2.5900 N 0 0 0 0 0 0 0 0 0 0 0 0 -2.8450 0.1700 -3.8700 N 0 0 0 0 0 0 0 0 0 0 0 0 -3.3490 1.3480 -4.1340 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.8700 1.6380 -5.4700 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.4180 2.8250 -5.8640 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.8370 2.8500 -7.1750 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.6450 1.7150 -7.8560 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.8840 0.5140 -6.8220 S 0 0 0 0 0 0 0 0 0 0 0 0 0.4640 -4.1950 -2.7000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.3400 -5.1340 -3.8720 C 0 0 0 0 0 0 0 0 0 0 0 0 0.3180 -4.6330 -5.1600 C 0 0 0 0 0 0 0 0 0 0 0 0 0.2030 -5.4940 -6.2360 C 0 0 0 0 0 0 0 0 0 0 0 0 0.1120 -6.8570 -6.0230 C 0 0 0 0 0 0 0 0 0 0 0 0 0.1350 -7.3580 -4.7350 C 0 0 0 0 0 0 0 0 0 0 0 0 0.2540 -6.4970 -3.6600 C 0 0 0 0 0 0 0 0 0 0 0 0 0.9120 1.8580 0.0030 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9580 1.8330 0.0170 H 0 0 0 0 0 0 0 0 0 0 0 0 0.9450 -0.5310 -0.0100 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.3740 -1.3390 0.9390 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.1300 -0.0810 -0.0680 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.3790 2.1070 -3.3660 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.5140 3.6730 -5.2020 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.2890 3.7230 -7.6220 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.9130 1.5610 -8.8910 H 0 0 0 0 0 0 0 0 0 0 0 0 1.0320 -3.3140 -2.9990 H 0 0 0 0 0 0 0 0 0 0 0 0 0.9800 -4.7000 -1.8840 H 0 0 0 0 0 0 0 0 0 0 0 0 0.3890 -3.5680 -5.3270 H 0 0 0 0 0 0 0 0 0 0 0 0 0.1850 -5.1020 -7.2420 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0220 -7.5300 -6.8630 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0630 -8.4230 -4.5690 H 0 0 0 0 0 0 0 0 0 0 0 0 0.2750 -6.8890 -2.6540 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 2 0 0 0 0 1 26 1 0 0 0 0 1 27 1 0 0 0 0 2 3 1 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 3 30 1 0 0 0 0 4 5 1 0 0 0 0 4 10 1 0 0 0 0 5 6 2 0 0 0 0 5 7 1 0 0 0 0 7 8 1 0 0 0 0 7 9 1 0 0 0 0 7 19 1 0 0 0 0 9 10 1 0 0 0 0 10 11 2 0 0 0 0 11 12 1 0 0 0 0 12 13 2 0 0 0 0 13 14 1 0 0 0 0 13 31 1 0 0 0 0 14 15 2 0 0 0 0 14 18 1 0 0 0 0 15 16 1 0 0 0 0 15 32 1 0 0 0 0 16 17 2 0 0 0 0 16 33 1 0 0 0 0 17 18 1 0 0 0 0 17 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 25 2 0 0 0 0 21 22 2 0 0 0 0 21 37 1 0 0 0 0 22 23 1 0 0 0 0 22 38 1 0 0 0 0 23 24 2 0 0 0 0 23 39 1 0 0 0 0 24 25 1 0 0 0 0 24 40 1 0 0 0 0 25 41 1 0 0 0 0 M END