NCID-ZINC05028512 MOE2007 3D CORINA 3.40 0006 02.08.2006 67 70 0 0 1 0 0 0 0 0999 V2000 0.0300 1.4350 -0.1670 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0310 0.0530 -0.1300 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2280 -0.6370 -0.1070 C 0 0 0 0 0 0 0 0 0 0 0 0 2.4250 0.0550 -0.1210 C 0 0 0 0 0 0 0 0 0 0 0 0 2.4240 1.4370 -0.1590 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2260 2.1270 -0.1810 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7300 -0.6970 -0.0960 C 0 0 0 0 0 0 0 0 0 0 0 0 4.1550 -0.9770 -1.4560 O 0 0 0 0 0 0 0 0 0 0 0 0 5.3120 -1.6480 -1.6090 C 0 0 0 0 0 0 0 0 0 0 0 0 5.9500 -1.9910 -0.6330 O 0 0 0 0 0 0 0 0 0 0 0 0 5.7630 -1.9400 -2.8450 N 0 0 0 0 0 0 0 0 0 0 0 0 5.0940 -1.5860 -4.1100 C 0 0 0 0 0 0 0 0 0 0 0 0 5.6160 -2.6190 -5.1380 C 0 0 0 0 0 0 0 0 0 0 0 0 7.0930 -2.7840 -4.6920 C 0 0 0 0 0 0 0 0 0 0 0 0 7.0070 -2.6590 -3.1560 C 0 0 3 0 0 0 0 0 0 0 0 0 6.9850 -3.6510 -2.7050 H 0 0 0 0 0 0 0 0 0 0 0 0 8.1900 -1.8840 -2.6360 C 0 0 0 0 0 0 0 0 0 0 0 0 8.0740 -0.7060 -2.3690 O 0 0 0 0 0 0 0 0 0 0 0 0 9.3780 -2.4990 -2.4660 N 0 0 0 0 0 0 0 0 0 0 0 0 9.6580 -3.9180 -2.7490 C 0 0 0 0 0 0 0 0 0 0 0 0 10.8720 -4.2690 -1.8530 C 0 0 3 0 0 0 0 0 0 0 0 0 10.5550 -4.4810 -0.8320 H 0 0 0 0 0 0 0 0 0 0 0 0 11.6970 -2.9570 -1.9190 C 0 0 0 0 0 0 0 0 0 0 0 0 10.6090 -1.8640 -1.9750 C 0 0 3 0 0 0 0 0 0 0 0 0 10.9140 -1.0690 -2.6550 H 0 0 0 0 0 0 0 0 0 0 0 0 10.3810 -1.3020 -0.5950 C 0 0 0 0 0 0 0 0 0 0 0 0 9.2960 -1.4160 -0.0660 O 0 0 0 0 0 0 0 0 0 0 0 0 11.3820 -0.6720 0.0500 N 0 0 0 0 0 0 0 0 0 0 0 0 11.1600 -0.1250 1.3910 C 0 0 0 0 0 0 0 0 0 0 0 0 12.4280 0.5220 1.8860 C 0 0 0 0 0 0 0 0 0 0 0 0 13.4150 0.5270 1.1900 O 0 0 0 0 0 0 0 0 0 0 0 0 12.4600 1.0940 3.1000 O 0 0 0 0 0 0 0 0 0 0 0 0 13.6590 1.5700 3.5270 C 0 0 0 0 0 0 0 0 0 0 0 0 14.1470 2.7710 3.0330 C 0 0 0 0 0 0 0 0 0 0 0 0 15.3670 3.2510 3.4690 C 0 0 0 0 0 0 0 0 0 0 0 0 16.1020 2.5360 4.3960 C 0 0 0 0 0 0 0 0 0 0 0 0 15.6180 1.3380 4.8900 C 0 0 0 0 0 0 0 0 0 0 0 0 14.3960 0.8570 4.4620 C 0 0 0 0 0 0 0 0 0 0 0 0 17.4080 3.0530 4.8610 N 0 3 0 0 0 0 0 0 0 0 0 0 17.8360 4.1070 4.4260 O 0 0 0 0 0 0 0 0 0 0 0 0 18.0560 2.4240 5.6780 O 0 5 0 0 0 0 0 0 0 0 0 0 11.6080 -5.3670 -2.3960 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.9060 1.9740 -0.1890 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9040 -0.4870 -0.1180 H 0 0 0 0 0 0 0 0 0 0 0 0 1.2290 -1.7160 -0.0770 H 0 0 0 0 0 0 0 0 0 0 0 0 3.3590 1.9770 -0.1700 H 0 0 0 0 0 0 0 0 0 0 0 0 1.2260 3.2070 -0.2100 H 0 0 0 0 0 0 0 0 0 0 0 0 4.4880 -0.0940 0.4050 H 0 0 0 0 0 0 0 0 0 0 0 0 3.5990 -1.6350 0.4440 H 0 0 0 0 0 0 0 0 0 0 0 0 4.0120 -1.6700 -4.0030 H 0 0 0 0 0 0 0 0 0 0 0 0 5.3680 -0.5760 -4.4140 H 0 0 0 0 0 0 0 0 0 0 0 0 5.0750 -3.5620 -5.0540 H 0 0 0 0 0 0 0 0 0 0 0 0 5.5570 -2.2250 -6.1530 H 0 0 0 0 0 0 0 0 0 0 0 0 7.4760 -3.7630 -4.9800 H 0 0 0 0 0 0 0 0 0 0 0 0 7.7120 -1.9890 -5.1060 H 0 0 0 0 0 0 0 0 0 0 0 0 8.7990 -4.5350 -2.4840 H 0 0 0 0 0 0 0 0 0 0 0 0 9.9110 -4.0520 -3.8010 H 0 0 0 0 0 0 0 0 0 0 0 0 12.3150 -2.8450 -1.0280 H 0 0 0 0 0 0 0 0 0 0 0 0 12.3100 -2.9320 -2.8200 H 0 0 0 0 0 0 0 0 0 0 0 0 12.2500 -0.5810 -0.3730 H 0 0 0 0 0 0 0 0 0 0 0 0 10.3630 0.6170 1.3530 H 0 0 0 0 0 0 0 0 0 0 0 0 10.8750 -0.9300 2.0690 H 0 0 0 0 0 0 0 0 0 0 0 0 13.5740 3.3290 2.3080 H 0 0 0 0 0 0 0 0 0 0 0 0 15.7470 4.1860 3.0840 H 0 0 0 0 0 0 0 0 0 0 0 0 16.1940 0.7810 5.6140 H 0 0 0 0 0 0 0 0 0 0 0 0 14.0160 -0.0760 4.8520 H 0 0 0 0 0 0 0 0 0 0 0 0 11.0990 -6.1860 -2.4650 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 43 1 0 0 0 0 2 3 2 0 0 0 0 2 44 1 0 0 0 0 3 4 1 0 0 0 0 3 45 1 0 0 0 0 4 5 2 0 0 0 0 4 7 1 0 0 0 0 5 6 1 0 0 0 0 5 46 1 0 0 0 0 6 47 1 0 0 0 0 7 8 1 0 0 0 0 7 48 1 0 0 0 0 7 49 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 12 1 0 0 0 0 11 15 1 0 0 0 0 12 13 1 0 0 0 0 12 50 1 0 0 0 0 12 51 1 0 0 0 0 13 14 1 0 0 0 0 13 52 1 0 0 0 0 13 53 1 0 0 0 0 14 15 1 0 0 0 0 14 54 1 0 0 0 0 14 55 1 0 0 0 0 15 16 1 0 0 0 0 15 17 1 0 0 0 0 17 18 2 0 0 0 0 17 19 1 0 0 0 0 19 20 1 0 0 0 0 19 24 1 0 0 0 0 20 21 1 0 0 0 0 20 56 1 0 0 0 0 20 57 1 0 0 0 0 21 22 1 0 0 0 0 21 23 1 0 0 0 0 21 42 1 0 0 0 0 23 24 1 0 0 0 0 23 58 1 0 0 0 0 23 59 1 0 0 0 0 24 25 1 0 0 0 0 24 26 1 0 0 0 0 26 27 2 0 0 0 0 26 28 1 0 0 0 0 28 29 1 0 0 0 0 28 60 1 0 0 0 0 29 30 1 0 0 0 0 29 61 1 0 0 0 0 29 62 1 0 0 0 0 30 31 2 0 0 0 0 30 32 1 0 0 0 0 32 33 1 0 0 0 0 33 34 1 0 0 0 0 33 38 2 0 0 0 0 34 35 2 0 0 0 0 34 63 1 0 0 0 0 35 36 1 0 0 0 0 35 64 1 0 0 0 0 36 37 2 0 0 0 0 36 39 1 0 0 0 0 37 38 1 0 0 0 0 37 65 1 0 0 0 0 38 66 1 0 0 0 0 39 40 2 0 0 0 0 39 41 1 0 0 0 0 42 67 1 0 0 0 0 M CHG 1 39 1 M CHG 1 41 -1 M END