NCID-ZINC04934670 MOE2007 3D CORINA 3.40 0006 02.08.2006 58 61 0 0 1 0 0 0 0 0999 V2000 -0.0170 1.3900 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 1.1730 -0.6950 -0.0120 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3940 0.0060 -0.0200 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3730 1.4490 -0.0130 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1360 2.1130 0.0030 C 0 0 0 0 0 0 0 0 0 0 0 0 3.5280 2.1240 -0.0200 N 0 0 0 0 0 0 0 0 0 0 0 0 4.6640 1.4680 -0.0330 C 0 0 0 0 0 0 0 0 0 0 0 0 4.6870 0.0630 -0.0410 C 0 0 0 0 0 0 0 0 0 0 0 0 3.5630 -0.6330 -0.0340 N 0 0 0 0 0 0 0 0 0 0 0 0 5.9880 -0.6480 -0.0580 C 0 0 0 0 0 0 0 0 0 0 0 0 7.0250 -0.0160 -0.0640 O 0 0 0 0 0 0 0 0 0 0 0 0 6.0190 -1.9950 -0.0650 N 0 0 0 0 0 0 0 0 0 0 0 0 7.3050 -2.6970 -0.0810 C 0 0 3 0 0 0 0 0 0 0 0 0 8.0330 -2.1360 0.5040 H 0 0 0 0 0 0 0 0 0 0 0 0 7.1310 -4.0930 0.5230 C 0 0 0 0 0 0 0 0 0 0 0 0 6.5460 -3.9420 2.2330 S 0 0 0 0 0 0 0 0 0 0 0 0 4.6240 -3.2650 2.0050 S 0 0 0 0 0 0 0 0 0 0 0 0 3.6800 -4.7930 1.7530 C 0 0 0 0 0 0 0 0 0 0 0 0 3.6350 -5.5860 3.0610 C 0 0 3 0 0 0 0 0 0 0 0 0 3.1560 -4.9850 3.8340 H 0 0 0 0 0 0 0 0 0 0 0 0 2.8500 -6.8550 2.8520 C 0 0 0 0 0 0 0 0 0 0 0 0 3.3770 -7.9270 3.0320 O 0 0 0 0 0 0 0 0 0 0 0 0 5.0000 -5.9180 3.4770 N 0 0 0 0 0 0 0 0 0 0 0 0 5.2710 -6.1470 4.7770 C 0 0 0 0 0 0 0 0 0 0 0 0 4.3830 -6.0770 5.6040 O 0 0 0 0 0 0 0 0 0 0 0 0 6.6520 -6.4830 5.1990 C 0 0 0 0 0 0 0 0 0 0 0 0 6.9240 -6.7200 6.5560 C 0 0 0 0 0 0 0 0 0 0 0 0 8.1370 -7.0200 6.9580 N 0 0 0 0 0 0 0 0 0 0 0 0 9.1290 -7.1020 6.0660 C 0 0 0 0 0 0 0 0 0 0 0 0 10.4410 -7.4200 6.4550 C 0 0 0 0 0 0 0 0 0 0 0 0 11.4230 -7.4940 5.5160 C 0 0 0 0 0 0 0 0 0 0 0 0 11.1560 -7.2600 4.1680 C 0 0 0 0 0 0 0 0 0 0 0 0 9.9030 -6.9490 3.7390 C 0 0 0 0 0 0 0 0 0 0 0 0 8.8520 -6.8600 4.6710 C 0 0 0 0 0 0 0 0 0 0 0 0 7.6100 -6.5620 4.2910 N 0 0 0 0 0 0 0 0 0 0 0 0 7.7920 -2.8220 -1.5020 C 0 0 0 0 0 0 0 0 0 0 0 0 7.1320 -2.3700 -2.4080 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.9660 1.9060 0.0170 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9320 -0.5460 0.0080 H 0 0 0 0 0 0 0 0 0 0 0 0 1.1670 -1.7750 -0.0180 H 0 0 0 0 0 0 0 0 0 0 0 0 1.0990 3.1930 0.0080 H 0 0 0 0 0 0 0 0 0 0 0 0 5.5950 2.0150 -0.0390 H 0 0 0 0 0 0 0 0 0 0 0 0 5.1910 -2.5000 -0.0600 H 0 0 0 0 0 0 0 0 0 0 0 0 6.4030 -4.6540 -0.0630 H 0 0 0 0 0 0 0 0 0 0 0 0 8.0880 -4.6150 0.5110 H 0 0 0 0 0 0 0 0 0 0 0 0 2.6640 -4.5450 1.4430 H 0 0 0 0 0 0 0 0 0 0 0 0 4.1590 -5.3930 0.9800 H 0 0 0 0 0 0 0 0 0 0 0 0 5.7080 -5.9740 2.8170 H 0 0 0 0 0 0 0 0 0 0 0 0 6.1240 -6.6540 7.2790 H 0 0 0 0 0 0 0 0 0 0 0 0 10.6690 -7.6050 7.4940 H 0 0 0 0 0 0 0 0 0 0 0 0 12.4300 -7.7390 5.8210 H 0 0 0 0 0 0 0 0 0 0 0 0 11.9600 -7.3270 3.4500 H 0 0 0 0 0 0 0 0 0 0 0 0 9.7170 -6.7710 2.6900 H 0 0 0 0 0 0 0 0 0 0 0 0 1.5660 -6.7940 2.4660 O 0 0 0 0 0 0 0 0 0 0 0 0 8.9580 -3.4350 -1.7610 O 0 0 0 0 0 0 0 0 0 0 0 0 9.2280 -3.4900 -2.6880 H 0 0 0 0 0 0 0 0 0 0 0 0 1.1040 -7.6350 2.3440 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 39 1 0 0 0 0 2 3 2 0 0 0 0 2 40 1 0 0 0 0 3 4 1 0 0 0 0 3 41 1 0 0 0 0 4 5 1 0 0 0 0 4 10 2 0 0 0 0 5 6 1 0 0 0 0 5 7 2 0 0 0 0 6 42 1 0 0 0 0 7 8 1 0 0 0 0 8 9 2 0 0 0 0 8 43 1 0 0 0 0 9 10 1 0 0 0 0 9 11 1 0 0 0 0 11 12 2 0 0 0 0 11 13 1 0 0 0 0 13 14 1 0 0 0 0 13 44 1 0 0 0 0 14 15 1 0 0 0 0 14 16 1 0 0 0 0 14 37 1 0 0 0 0 16 17 1 0 0 0 0 16 45 1 0 0 0 0 16 46 1 0 0 0 0 17 18 1 0 0 0 0 18 19 1 0 0 0 0 19 20 1 0 0 0 0 19 47 1 0 0 0 0 19 48 1 0 0 0 0 20 21 1 0 0 0 0 20 22 1 0 0 0 0 20 24 1 0 0 0 0 22 23 2 0 0 0 0 22 55 1 0 0 0 0 24 25 1 0 0 0 0 24 49 1 0 0 0 0 25 26 2 0 0 0 0 25 27 1 0 0 0 0 27 28 1 0 0 0 0 27 36 2 0 0 0 0 28 29 2 0 0 0 0 28 50 1 0 0 0 0 29 30 1 0 0 0 0 30 31 1 0 0 0 0 30 35 2 0 0 0 0 31 32 2 0 0 0 0 31 51 1 0 0 0 0 32 33 1 0 0 0 0 32 52 1 0 0 0 0 33 34 2 0 0 0 0 33 53 1 0 0 0 0 34 35 1 0 0 0 0 34 54 1 0 0 0 0 35 36 1 0 0 0 0 37 38 2 0 0 0 0 37 56 1 0 0 0 0 55 58 1 0 0 0 0 56 57 1 0 0 0 0 M END