CHEMDIV-ZINC00662995 MOE2007 3D CORINA 3.40 0006 02.08.2006 53 56 0 0 0 0 0 0 0 0999 V2000 0.1310 1.2190 0.8050 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0020 0.0000 0.0040 N 0 0 0 0 0 0 0 0 0 0 0 0 1.1240 -0.4690 -0.8090 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.2020 -0.7170 0.0140 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.2700 -0.2730 0.7850 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.4550 -0.9810 0.7960 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.5800 -2.1370 0.0360 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.5130 -2.5810 -0.7340 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.3300 -1.8700 -0.7500 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.7820 -2.8550 0.0480 N 0 0 0 0 0 0 0 0 0 0 0 0 -4.7670 -4.1970 -0.0750 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.7080 -4.7930 -0.1020 O 0 0 0 0 0 0 0 0 0 0 0 0 -6.0390 -4.9450 -0.1780 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.2570 -4.2870 -0.2680 C 0 0 0 0 0 0 0 0 0 0 0 0 -8.4390 -5.0380 -0.3650 C 0 0 0 0 0 0 0 0 0 0 0 0 -8.4380 -6.3540 -0.3730 N 0 0 0 0 0 0 0 0 0 0 0 0 -7.3130 -7.0670 -0.2900 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.0620 -6.4080 -0.1940 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.8840 -7.1590 -0.1140 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.9510 -8.5210 -0.1330 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.1770 -9.1740 -0.2320 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.3430 -8.4740 -0.3020 C 0 0 0 0 0 0 0 0 0 0 0 0 -9.7340 -4.3230 -0.4600 C 0 0 0 0 0 0 0 0 0 0 0 0 -9.7670 -2.9290 -0.4540 C 0 0 0 0 0 0 0 0 0 0 0 0 -10.9740 -2.2690 -0.5430 C 0 0 0 0 0 0 0 0 0 0 0 0 -12.1550 -2.9850 -0.6390 C 0 0 0 0 0 0 0 0 0 0 0 0 -12.1350 -4.3660 -0.6450 C 0 0 0 0 0 0 0 0 0 0 0 0 -10.9280 -5.0440 -0.5630 C 0 0 0 0 0 0 0 0 0 0 0 0 -10.9070 -6.4010 -0.5760 O 0 0 0 0 0 0 0 0 0 0 0 0 -12.1650 -7.0690 -0.6840 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1290 1.6360 0.6700 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.6130 1.9480 0.4830 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0240 0.9810 1.8570 H 0 0 0 0 0 0 0 0 0 0 0 0 1.7430 -1.1430 -0.2170 H 0 0 0 0 0 0 0 0 0 0 0 0 0.7450 -0.9970 -1.6840 H 0 0 0 0 0 0 0 0 0 0 0 0 1.7210 0.3850 -1.1300 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.1720 0.6260 1.3760 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.2850 -0.6350 1.3940 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.6110 -3.4810 -1.3230 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5020 -2.2130 -1.3520 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.6260 -2.3860 0.1440 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.2950 -3.2080 -0.2640 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.9280 -6.6630 -0.0370 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.0420 -9.1000 -0.0710 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.2050 -10.2530 -0.2450 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.2850 -8.9960 -0.3780 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.8470 -2.3670 -0.3790 H 0 0 0 0 0 0 0 0 0 0 0 0 -10.9990 -1.1890 -0.5380 H 0 0 0 0 0 0 0 0 0 0 0 0 -13.0970 -2.4610 -0.7080 H 0 0 0 0 0 0 0 0 0 0 0 0 -13.0600 -4.9190 -0.7200 H 0 0 0 0 0 0 0 0 0 0 0 0 -12.7960 -6.7950 0.1620 H 0 0 0 0 0 0 0 0 0 0 0 0 -12.6550 -6.7750 -1.6120 H 0 0 0 0 0 0 0 0 0 0 0 0 -12.0060 -8.1480 -0.6830 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 31 1 0 0 0 0 1 32 1 0 0 0 0 1 33 1 0 0 0 0 2 3 1 0 0 0 0 2 4 1 0 0 0 0 3 34 1 0 0 0 0 3 35 1 0 0 0 0 3 36 1 0 0 0 0 4 5 1 0 0 0 0 4 9 2 0 0 0 0 5 6 2 0 0 0 0 5 37 1 0 0 0 0 6 7 1 0 0 0 0 6 38 1 0 0 0 0 7 8 2 0 0 0 0 7 10 1 0 0 0 0 8 9 1 0 0 0 0 8 39 1 0 0 0 0 9 40 1 0 0 0 0 10 11 1 0 0 0 0 10 41 1 0 0 0 0 11 12 2 0 0 0 0 11 13 1 0 0 0 0 13 14 2 0 0 0 0 13 18 1 0 0 0 0 14 15 1 0 0 0 0 14 42 1 0 0 0 0 15 16 2 0 0 0 0 15 23 1 0 0 0 0 16 17 1 0 0 0 0 17 18 1 0 0 0 0 17 22 2 0 0 0 0 18 19 2 0 0 0 0 19 20 1 0 0 0 0 19 43 1 0 0 0 0 20 21 2 0 0 0 0 20 44 1 0 0 0 0 21 22 1 0 0 0 0 21 45 1 0 0 0 0 22 46 1 0 0 0 0 23 24 1 0 0 0 0 23 28 2 0 0 0 0 24 25 2 0 0 0 0 24 47 1 0 0 0 0 25 26 1 0 0 0 0 25 48 1 0 0 0 0 26 27 2 0 0 0 0 26 49 1 0 0 0 0 27 28 1 0 0 0 0 27 50 1 0 0 0 0 28 29 1 0 0 0 0 29 30 1 0 0 0 0 30 51 1 0 0 0 0 30 52 1 0 0 0 0 30 53 1 0 0 0 0 M END