IFLAB-ZINC04087105 MOE2007 3D CORINA 3.40 0006 02.08.2006 45 48 0 0 0 0 0 0 0 0999 V2000 -0.0130 1.0860 0.0080 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0160 1.0910 2.4300 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.5060 1.9000 3.6350 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.0270 1.9010 3.6180 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.7370 1.5620 2.5330 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.4580 1.6690 2.8560 S 0 0 0 0 0 0 0 0 0 0 0 0 -4.2070 2.1740 4.4630 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.8700 2.2570 4.7420 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.3420 2.6660 6.0470 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.1190 3.8410 6.2730 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.1030 1.7400 6.9970 N 0 0 0 0 0 0 0 0 0 0 0 0 -5.2180 2.4610 5.3660 N 0 0 0 0 0 0 0 0 0 0 0 0 -6.5080 2.3470 4.9910 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.7830 1.9920 3.8620 O 0 0 0 0 0 0 0 0 0 0 0 0 -7.5860 2.6530 5.9530 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.2610 3.0630 7.2590 C 0 0 0 0 0 0 0 0 0 0 0 0 -8.2340 3.3500 8.1610 C 0 0 0 0 0 0 0 0 0 0 0 0 -9.5880 3.2390 7.7940 C 0 0 0 0 0 0 0 0 0 0 0 0 -10.6120 3.5320 8.7100 C 0 0 0 0 0 0 0 0 0 0 0 0 -11.9140 3.4160 8.3270 C 0 0 0 0 0 0 0 0 0 0 0 0 -12.2490 3.0100 7.0370 C 0 0 0 0 0 0 0 0 0 0 0 0 -11.2840 2.7180 6.1220 C 0 0 0 0 0 0 0 0 0 0 0 0 -9.9290 2.8260 6.4810 C 0 0 0 0 0 0 0 0 0 0 0 0 -8.9100 2.5390 5.5610 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.1120 1.1470 1.2160 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0020 -0.0040 0.0020 H 0 0 0 0 0 0 0 0 0 0 0 0 1.0100 1.4630 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5400 1.4470 -0.8750 H 0 0 0 0 0 0 0 0 0 0 0 0 1.0600 1.2250 2.3160 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.2360 0.0350 2.5870 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.1490 1.4420 4.5560 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.1380 2.9240 3.5650 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.2810 0.8040 6.8180 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.7540 2.0110 7.8610 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.9980 2.7450 6.2670 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.2240 3.1510 7.5480 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.9680 3.6640 9.1590 H 0 0 0 0 0 0 0 0 0 0 0 0 -10.3680 3.8470 9.7140 H 0 0 0 0 0 0 0 0 0 0 0 0 -12.6980 3.6410 9.0340 H 0 0 0 0 0 0 0 0 0 0 0 0 -13.2890 2.9250 6.7590 H 0 0 0 0 0 0 0 0 0 0 0 0 -11.5580 2.4040 5.1260 H 0 0 0 0 0 0 0 0 0 0 0 0 -9.1550 2.2270 4.5560 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.1770 0.0650 1.1040 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.6370 1.6320 0.3930 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.7000 1.5600 1.2170 N 0 0 0 0 0 0 0 0 0 0 0 0 1 26 1 0 0 0 0 1 27 1 0 0 0 0 1 28 1 0 0 0 0 1 45 1 0 0 0 0 2 3 1 0 0 0 0 2 29 1 0 0 0 0 2 30 1 0 0 0 0 2 45 1 0 0 0 0 3 4 1 0 0 0 0 3 31 1 0 0 0 0 3 32 1 0 0 0 0 4 5 2 0 0 0 0 4 8 1 0 0 0 0 5 6 1 0 0 0 0 5 25 1 0 0 0 0 6 7 1 0 0 0 0 7 8 2 0 0 0 0 7 12 1 0 0 0 0 8 9 1 0 0 0 0 9 10 2 0 0 0 0 9 11 1 0 0 0 0 11 33 1 0 0 0 0 11 34 1 0 0 0 0 12 13 1 0 0 0 0 12 35 1 0 0 0 0 13 14 2 0 0 0 0 13 15 1 0 0 0 0 15 16 1 0 0 0 0 15 24 2 0 0 0 0 16 17 2 0 0 0 0 16 36 1 0 0 0 0 17 18 1 0 0 0 0 17 37 1 0 0 0 0 18 19 1 0 0 0 0 18 23 2 0 0 0 0 19 20 2 0 0 0 0 19 38 1 0 0 0 0 20 21 1 0 0 0 0 20 39 1 0 0 0 0 21 22 2 0 0 0 0 21 40 1 0 0 0 0 22 23 1 0 0 0 0 22 41 1 0 0 0 0 23 24 1 0 0 0 0 24 42 1 0 0 0 0 25 43 1 0 0 0 0 25 44 1 0 0 0 0 25 45 1 0 0 0 0 M END