IBS-ZINC02130180 MOE2007 3D CORINA 3.40 0006 02.08.2006 51 52 0 0 1 0 0 0 0 0999 V2000 -0.0120 1.8130 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0100 0.0000 -0.0070 S 0 0 0 0 0 0 0 0 0 0 0 0 0.8830 -0.3920 -1.5480 C 0 0 0 0 0 0 0 0 0 0 0 0 0.9870 -1.9100 -1.7040 C 0 0 0 0 0 0 0 0 0 0 0 0 1.7240 -2.2410 -3.0040 C 0 0 3 0 0 0 0 0 0 0 0 0 2.6900 -1.7360 -3.0120 H 0 0 0 0 0 0 0 0 0 0 0 0 1.9340 -3.7300 -3.0980 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1960 -4.4040 -3.7850 O 0 0 0 0 0 0 0 0 0 0 0 0 2.9410 -4.3120 -2.4180 N 0 0 0 0 0 0 0 0 0 0 0 0 3.1590 -5.7630 -2.4990 C 0 0 0 0 0 0 0 0 0 0 0 0 3.1960 -6.3370 -1.0790 C 0 0 0 0 0 0 0 0 0 0 0 0 4.2490 -5.5880 -0.2590 C 0 0 0 0 0 0 0 0 0 0 0 0 3.8730 -4.1070 -0.1720 C 0 0 0 0 0 0 0 0 0 0 0 0 3.8470 -3.5080 -1.5860 C 0 0 0 0 0 0 0 0 0 0 0 0 4.3130 -6.1720 1.1290 C 0 0 0 0 0 0 0 0 0 0 0 0 3.3030 -6.5810 1.6620 O 0 0 0 0 0 0 0 0 0 0 0 0 5.4920 -6.2400 1.7780 N 0 0 0 0 0 0 0 0 0 0 0 0 6.7710 -5.6870 1.2970 C 0 0 0 0 0 0 0 0 0 0 0 0 7.6120 -5.4600 2.5780 C 0 0 0 0 0 0 0 0 0 0 0 0 7.2050 -6.6850 3.4390 C 0 0 0 0 0 0 0 0 0 0 0 0 5.7150 -6.8730 3.0870 C 0 0 3 0 0 0 0 0 0 0 0 0 5.0900 -6.3940 3.8410 H 0 0 0 0 0 0 0 0 0 0 0 0 5.3910 -8.3420 3.0080 C 0 0 0 0 0 0 0 0 0 0 0 0 5.0110 -8.8220 1.9650 O 0 0 0 0 0 0 0 0 0 0 0 0 1.0110 2.1890 -0.0090 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5390 2.1740 -0.8840 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5220 2.1670 0.8960 H 0 0 0 0 0 0 0 0 0 0 0 0 0.3340 0.0240 -2.3930 H 0 0 0 0 0 0 0 0 0 0 0 0 1.8840 0.0390 -1.5180 H 0 0 0 0 0 0 0 0 0 0 0 0 1.5360 -2.3260 -0.8590 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0140 -2.3420 -1.7340 H 0 0 0 0 0 0 0 0 0 0 0 0 2.3440 -6.2240 -3.0580 H 0 0 0 0 0 0 0 0 0 0 0 0 4.1070 -5.9630 -2.9990 H 0 0 0 0 0 0 0 0 0 0 0 0 2.2190 -6.2170 -0.6120 H 0 0 0 0 0 0 0 0 0 0 0 0 3.4530 -7.3950 -1.1210 H 0 0 0 0 0 0 0 0 0 0 0 0 5.2230 -5.6880 -0.7390 H 0 0 0 0 0 0 0 0 0 0 0 0 2.8890 -4.0080 0.2860 H 0 0 0 0 0 0 0 0 0 0 0 0 4.6110 -3.5790 0.4320 H 0 0 0 0 0 0 0 0 0 0 0 0 4.8500 -3.5280 -2.0130 H 0 0 0 0 0 0 0 0 0 0 0 0 3.4860 -2.4800 -1.5420 H 0 0 0 0 0 0 0 0 0 0 0 0 7.2680 -6.3980 0.6380 H 0 0 0 0 0 0 0 0 0 0 0 0 6.6050 -4.7420 0.7800 H 0 0 0 0 0 0 0 0 0 0 0 0 8.6780 -5.4760 2.3540 H 0 0 0 0 0 0 0 0 0 0 0 0 7.3320 -4.5270 3.0690 H 0 0 0 0 0 0 0 0 0 0 0 0 7.7860 -7.5630 3.1580 H 0 0 0 0 0 0 0 0 0 0 0 0 7.3240 -6.4670 4.5000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.4180 -1.9340 -5.0160 H 0 0 0 0 0 0 0 0 0 0 0 0 5.5240 -9.1190 4.0940 O 0 0 0 0 0 0 0 0 0 0 0 0 0.9240 -1.7860 -4.1490 N 0 0 0 0 0 0 0 0 0 0 0 0 0.0230 -2.2400 -4.1640 H 0 0 0 0 0 0 0 0 0 0 0 0 5.3040 -10.0550 3.9950 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 25 1 0 0 0 0 1 26 1 0 0 0 0 1 27 1 0 0 0 0 2 3 1 0 0 0 0 3 4 1 0 0 0 0 3 28 1 0 0 0 0 3 29 1 0 0 0 0 4 5 1 0 0 0 0 4 30 1 0 0 0 0 4 31 1 0 0 0 0 5 6 1 0 0 0 0 5 7 1 0 0 0 0 5 49 1 0 0 0 0 7 8 2 0 0 0 0 7 9 1 0 0 0 0 9 10 1 0 0 0 0 9 14 1 0 0 0 0 10 11 1 0 0 0 0 10 32 1 0 0 0 0 10 33 1 0 0 0 0 11 12 1 0 0 0 0 11 34 1 0 0 0 0 11 35 1 0 0 0 0 12 13 1 0 0 0 0 12 15 1 0 0 0 0 12 36 1 0 0 0 0 13 14 1 0 0 0 0 13 37 1 0 0 0 0 13 38 1 0 0 0 0 14 39 1 0 0 0 0 14 40 1 0 0 0 0 15 16 2 0 0 0 0 15 17 1 0 0 0 0 17 18 1 0 0 0 0 17 21 1 0 0 0 0 18 19 1 0 0 0 0 18 41 1 0 0 0 0 18 42 1 0 0 0 0 19 20 1 0 0 0 0 19 43 1 0 0 0 0 19 44 1 0 0 0 0 20 21 1 0 0 0 0 20 45 1 0 0 0 0 20 46 1 0 0 0 0 21 22 1 0 0 0 0 21 23 1 0 0 0 0 23 24 2 0 0 0 0 23 48 1 0 0 0 0 47 49 1 0 0 0 0 48 51 1 0 0 0 0 49 50 1 0 0 0 0 M END