IBS-ZINC05253995 MOE2007 3D CORINA 3.40 0006 02.08.2006 45 48 0 0 0 0 0 0 0 0999 V2000 0.0180 0.7480 -2.6300 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.7700 -0.2440 -3.4880 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.9290 -0.6780 -2.7730 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.7440 -1.5680 -3.3990 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.4340 -2.0150 -4.6740 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.2640 -2.9200 -5.3090 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.4030 -3.3820 -4.6750 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.7170 -2.9400 -3.4040 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.8870 -2.0370 -2.7590 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.1910 -1.6060 -1.5060 O 0 0 0 0 0 0 0 0 0 0 0 0 -5.2460 -2.1750 -0.8780 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.2430 -1.3760 -0.2670 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.1870 0.0220 -0.2840 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.1760 0.7410 0.3190 C 0 0 0 0 0 0 0 0 0 0 0 0 -8.2400 0.1040 0.9530 C 0 0 0 0 0 0 0 0 0 0 0 0 -8.3240 -1.2560 0.9870 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.3250 -2.0270 0.3770 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.3620 -3.3660 0.3820 N 0 0 0 0 0 0 0 0 0 0 0 0 -6.4040 -4.0630 -0.2020 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.3740 -3.4900 -0.8230 N 0 0 0 0 0 0 0 0 0 0 0 0 -6.4830 -5.5420 -0.1730 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.7060 -6.1820 -0.3680 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.7730 -7.5600 -0.3400 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.6310 -8.3100 -0.1180 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.4140 -7.6860 0.0770 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.3290 -6.3030 0.0450 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.1330 -5.6880 0.2300 O 0 0 0 0 0 0 0 0 0 0 0 0 0.9020 1.0780 -3.1760 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.6110 1.6080 -2.4010 H 0 0 0 0 0 0 0 0 0 0 0 0 0.3230 0.2630 -1.7030 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0760 0.2400 -4.4160 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.1420 -1.1050 -3.7180 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.5460 -1.6560 -5.1720 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.0220 -3.2670 -6.3030 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.0480 -4.0890 -5.1750 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.6070 -3.3030 -2.9110 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.3670 0.5270 -0.7720 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.1330 1.8200 0.3060 H 0 0 0 0 0 0 0 0 0 0 0 0 -9.0100 0.6970 1.4240 H 0 0 0 0 0 0 0 0 0 0 0 0 -9.1550 -1.7360 1.4830 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.5990 -5.6010 -0.5410 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.7210 -8.0550 -0.4910 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.6920 -9.3880 -0.0970 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.5270 -8.2770 0.2510 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.9580 -5.4360 1.1470 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 28 1 0 0 0 0 1 29 1 0 0 0 0 1 30 1 0 0 0 0 2 3 1 0 0 0 0 2 31 1 0 0 0 0 2 32 1 0 0 0 0 3 4 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 33 1 0 0 0 0 6 7 1 0 0 0 0 6 34 1 0 0 0 0 7 8 2 0 0 0 0 7 35 1 0 0 0 0 8 9 1 0 0 0 0 8 36 1 0 0 0 0 9 10 1 0 0 0 0 10 11 1 0 0 0 0 11 12 1 0 0 0 0 11 20 2 0 0 0 0 12 13 1 0 0 0 0 12 17 2 0 0 0 0 13 14 2 0 0 0 0 13 37 1 0 0 0 0 14 15 1 0 0 0 0 14 38 1 0 0 0 0 15 16 2 0 0 0 0 15 39 1 0 0 0 0 16 17 1 0 0 0 0 16 40 1 0 0 0 0 17 18 1 0 0 0 0 18 19 2 0 0 0 0 19 20 1 0 0 0 0 19 21 1 0 0 0 0 21 22 1 0 0 0 0 21 26 2 0 0 0 0 22 23 2 0 0 0 0 22 41 1 0 0 0 0 23 24 1 0 0 0 0 23 42 1 0 0 0 0 24 25 2 0 0 0 0 24 43 1 0 0 0 0 25 26 1 0 0 0 0 25 44 1 0 0 0 0 26 27 1 0 0 0 0 27 45 1 0 0 0 0 M END