IBS-ZINC01321331 MOE2007 3D CORINA 3.40 0006 02.08.2006 46 48 0 0 0 0 0 0 0 0999 V2000 -0.0280 1.5370 -0.0920 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0080 0.0310 -0.0470 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2060 -0.5910 -0.0650 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2720 -2.0030 -0.0250 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3450 -2.5840 -0.0400 O 0 0 0 0 0 0 0 0 0 0 0 0 0.0040 -2.7490 0.0370 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0200 -4.1440 0.0800 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.2170 -4.8010 0.1370 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.4110 -4.0950 0.1530 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.4120 -2.7140 0.1110 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.1990 -2.0240 0.0520 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.1630 -0.6470 0.0150 N 0 0 0 0 0 0 0 0 0 0 0 0 -2.4220 0.1020 0.0370 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.8960 0.2470 1.4600 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.2460 -0.2290 2.3670 O 0 0 0 0 0 0 0 0 0 0 0 0 -4.0420 0.9050 1.7250 N 0 0 0 0 0 0 0 0 0 0 0 0 -4.4270 1.1320 3.0510 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.4640 1.3690 4.0240 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.8450 1.5940 5.3330 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.1840 1.5840 5.6770 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.1490 1.3480 4.7090 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.7720 1.1270 3.3940 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.4650 1.3380 5.0500 O 0 0 0 0 0 0 0 0 0 0 0 0 -7.7820 1.5780 6.4220 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.5880 -2.0300 0.1260 O 0 0 0 0 0 0 0 0 0 0 0 0 -4.7870 -2.8040 0.1870 C 0 0 0 0 0 0 0 0 0 0 0 0 0.9900 1.9230 -0.1350 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5770 1.8610 -0.9750 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5230 1.9150 0.8030 H 0 0 0 0 0 0 0 0 0 0 0 0 2.1140 -0.0090 -0.1110 H 0 0 0 0 0 0 0 0 0 0 0 0 0.9050 -4.7020 0.0680 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.2330 -5.8810 0.1700 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.3480 -4.6290 0.1980 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.2650 1.0900 -0.3960 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.1730 -0.4340 -0.5440 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.5990 1.2200 0.9970 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.4180 1.3770 3.7580 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.0950 1.7780 6.0880 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.4780 1.7610 6.7010 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.5220 0.9480 2.6380 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.3130 0.8140 7.0430 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.4110 2.5610 6.7140 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.8630 1.5430 6.5570 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.8410 -3.4590 -0.6820 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.7860 -3.4050 1.0960 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.6500 -2.1370 0.1930 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 27 1 0 0 0 0 1 28 1 0 0 0 0 1 29 1 0 0 0 0 2 3 2 0 0 0 0 2 12 1 0 0 0 0 3 4 1 0 0 0 0 3 30 1 0 0 0 0 4 5 2 0 0 0 0 4 6 1 0 0 0 0 6 7 1 0 0 0 0 6 11 2 0 0 0 0 7 8 2 0 0 0 0 7 31 1 0 0 0 0 8 9 1 0 0 0 0 8 32 1 0 0 0 0 9 10 2 0 0 0 0 9 33 1 0 0 0 0 10 11 1 0 0 0 0 10 25 1 0 0 0 0 11 12 1 0 0 0 0 12 13 1 0 0 0 0 13 14 1 0 0 0 0 13 34 1 0 0 0 0 13 35 1 0 0 0 0 14 15 2 0 0 0 0 14 16 1 0 0 0 0 16 17 1 0 0 0 0 16 36 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 18 37 1 0 0 0 0 19 20 1 0 0 0 0 19 38 1 0 0 0 0 20 21 2 0 0 0 0 20 39 1 0 0 0 0 21 22 1 0 0 0 0 21 23 1 0 0 0 0 22 40 1 0 0 0 0 23 24 1 0 0 0 0 24 41 1 0 0 0 0 24 42 1 0 0 0 0 24 43 1 0 0 0 0 25 26 1 0 0 0 0 26 44 1 0 0 0 0 26 45 1 0 0 0 0 26 46 1 0 0 0 0 M END