NCID-ZINC05030565 MOE2007 3D CORINA 3.40 0006 02.08.2006 62 65 0 0 1 0 0 0 0 0999 V2000 -0.0340 1.5140 0.0230 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0110 0.0070 0.0120 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0120 -0.6930 1.2030 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0340 -2.0750 1.1930 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0320 -2.7570 -0.0090 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0080 -2.0570 -1.2010 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0180 -0.6750 -1.1910 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0610 -4.5190 -0.0230 S 0 0 0 0 0 0 0 0 0 0 0 0 0.5980 -4.9020 -1.2810 O 0 0 0 0 0 0 0 0 0 0 0 0 0.6250 -4.9210 1.2180 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.5130 -5.0350 -0.0090 N 0 0 0 0 0 0 0 0 0 0 0 0 -2.1670 -5.2360 -1.1810 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.4050 -5.6420 -1.2250 N 0 0 0 0 0 0 0 0 0 0 0 0 -4.0970 -5.8820 -0.1020 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.4850 -5.6950 1.1400 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.1370 -5.2580 1.1690 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.5570 -5.0850 2.2270 O 0 0 0 0 0 0 0 0 0 0 0 0 -4.3980 -6.0050 2.0900 N 0 0 0 0 0 0 0 0 0 0 0 0 -5.5100 -6.3640 1.5170 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.3720 -6.3030 0.1620 N 0 0 0 0 0 0 0 0 0 0 0 0 -6.4000 -6.6290 -0.8290 C 0 0 3 0 0 0 0 0 0 0 0 0 -6.3750 -5.9120 -1.6500 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.1970 -8.0650 -1.3620 C 0 0 3 0 0 0 0 0 0 0 0 0 -6.4940 -8.1290 -2.4090 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.1280 -8.9270 -0.4820 C 0 0 3 0 0 0 0 0 0 0 0 0 -6.5510 -9.6640 0.0770 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.7840 -7.9110 0.4790 C 0 0 3 0 0 0 0 0 0 0 0 0 -7.2310 -7.8650 1.4180 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.7060 -6.6430 -0.2130 O 0 0 0 0 0 0 0 0 0 0 0 0 -9.2430 -8.2890 0.7400 C 0 0 0 0 0 0 0 0 0 0 0 0 -9.8050 -7.3930 1.7340 O 0 0 0 0 0 0 0 0 0 0 0 0 -11.0870 -7.5910 2.0780 C 0 0 0 0 0 0 0 0 0 0 0 0 -11.7190 -8.4840 1.5650 O 0 0 0 0 0 0 0 0 0 0 0 0 -11.7390 -6.7000 3.1040 C 0 0 0 0 0 0 0 0 0 0 0 0 -8.1350 -9.5840 -1.2970 O 0 0 0 0 0 0 0 0 0 0 0 0 -8.5910 -10.7700 -0.8640 C 0 0 0 0 0 0 0 0 0 0 0 0 -8.1630 -11.2440 0.1610 O 0 0 0 0 0 0 0 0 0 0 0 0 -9.6370 -11.5100 -1.6580 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.8140 -8.4770 -1.2010 O 0 0 0 0 0 0 0 0 0 0 0 0 -3.9830 -8.2380 -2.2280 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.3980 -7.7030 -3.2290 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.5330 -8.6380 -2.1330 C 0 0 0 0 0 0 0 0 0 0 0 0 0.9880 1.8930 0.0150 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5620 1.8760 -0.8590 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5440 1.8620 0.9210 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0140 -0.1600 2.1430 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0530 -2.6220 2.1240 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0070 -2.5900 -2.1400 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0400 -0.1280 -2.1220 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.6440 -5.0540 -2.1090 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.4080 -6.6650 2.0360 H 0 0 0 0 0 0 0 0 0 0 0 0 -9.8110 -8.2060 -0.1870 H 0 0 0 0 0 0 0 0 0 0 0 0 -9.2930 -9.3150 1.1060 H 0 0 0 0 0 0 0 0 0 0 0 0 -12.1950 -5.8450 2.6050 H 0 0 0 0 0 0 0 0 0 0 0 0 -12.5060 -7.2610 3.6380 H 0 0 0 0 0 0 0 0 0 0 0 0 -10.9870 -6.3500 3.8110 H 0 0 0 0 0 0 0 0 0 0 0 0 -9.8980 -10.9310 -2.5440 H 0 0 0 0 0 0 0 0 0 0 0 0 -9.2440 -12.4800 -1.9610 H 0 0 0 0 0 0 0 0 0 0 0 0 -10.5250 -11.6530 -1.0430 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.4630 -9.7150 -1.9820 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.0200 -8.3660 -3.0550 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.0680 -8.1220 -1.2930 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 43 1 0 0 0 0 1 44 1 0 0 0 0 1 45 1 0 0 0 0 2 3 1 0 0 0 0 2 7 2 0 0 0 0 3 4 2 0 0 0 0 3 46 1 0 0 0 0 4 5 1 0 0 0 0 4 47 1 0 0 0 0 5 6 2 0 0 0 0 5 8 1 0 0 0 0 6 7 1 0 0 0 0 6 48 1 0 0 0 0 7 49 1 0 0 0 0 8 9 2 0 0 0 0 8 10 2 0 0 0 0 8 11 1 0 0 0 0 11 12 1 0 0 0 0 11 16 1 0 0 0 0 12 13 2 0 0 0 0 12 50 1 0 0 0 0 13 14 1 0 0 0 0 14 15 2 0 0 0 0 14 20 1 0 0 0 0 15 16 1 0 0 0 0 15 18 1 0 0 0 0 16 17 2 0 0 0 0 18 19 2 0 0 0 0 19 20 1 0 0 0 0 19 51 1 0 0 0 0 20 21 1 0 0 0 0 21 22 1 0 0 0 0 21 23 1 0 0 0 0 21 29 1 0 0 0 0 23 24 1 0 0 0 0 23 25 1 0 0 0 0 23 39 1 0 0 0 0 25 26 1 0 0 0 0 25 27 1 0 0 0 0 25 35 1 0 0 0 0 27 28 1 0 0 0 0 27 29 1 0 0 0 0 27 30 1 0 0 0 0 30 31 1 0 0 0 0 30 52 1 0 0 0 0 30 53 1 0 0 0 0 31 32 1 0 0 0 0 32 33 2 0 0 0 0 32 34 1 0 0 0 0 34 54 1 0 0 0 0 34 55 1 0 0 0 0 34 56 1 0 0 0 0 35 36 1 0 0 0 0 36 37 2 0 0 0 0 36 38 1 0 0 0 0 38 57 1 0 0 0 0 38 58 1 0 0 0 0 38 59 1 0 0 0 0 39 40 1 0 0 0 0 40 41 2 0 0 0 0 40 42 1 0 0 0 0 42 60 1 0 0 0 0 42 61 1 0 0 0 0 42 62 1 0 0 0 0 M END