IBS-ZINC02114971 MOE2007 3D CORINA 3.40 0006 02.08.2006 45 45 0 0 1 0 0 0 0 0999 V2000 -3.4900 -0.4760 1.1660 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.2470 0.4080 1.0520 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.2940 -0.1840 0.0120 C 0 0 3 0 0 0 0 0 0 0 0 0 -1.1180 -1.2360 0.2370 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0350 0.5750 0.0480 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.9160 -0.0570 -1.3800 C 0 0 3 0 0 0 0 0 0 0 0 0 -1.1910 -0.3680 -2.1320 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.1370 -0.9360 -1.4660 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.2190 -0.4490 -1.7140 O 0 0 0 0 0 0 0 0 0 0 0 0 -3.0260 -2.2650 -1.2680 N 0 0 0 0 0 0 0 0 0 0 0 0 -4.0960 -3.0640 -1.4460 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.1610 -2.5870 -1.7860 O 0 0 0 0 0 0 0 0 0 0 0 0 -3.9860 -4.3930 -1.2480 N 0 0 0 0 0 0 0 0 0 0 0 0 -5.1490 -5.2620 -1.4420 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.7620 -6.6900 -1.1580 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.8850 -7.1990 0.1210 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.5300 -8.5100 0.3810 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.0520 -9.3110 -0.6380 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.9290 -8.8030 -1.9180 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.2880 -7.4940 -2.1790 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.3000 1.3360 -1.6190 N 0 0 0 0 0 0 0 0 0 0 0 0 -1.4380 2.1790 -2.2210 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.3820 1.7620 -2.6500 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.7850 3.6390 -2.3620 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.0520 -0.2000 2.0580 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.1170 -0.3360 0.2840 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.1890 -1.5210 1.2350 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.5410 1.4120 0.7460 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.7450 0.4550 2.0190 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5260 0.4030 1.0050 H 0 0 0 0 0 0 0 0 0 0 0 0 0.6770 0.2210 -0.7590 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.1520 1.6410 -0.0790 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.1760 -2.6460 -0.9960 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.1360 -4.7740 -0.9770 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.9460 -4.9600 -0.7620 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.4980 -5.1780 -2.4710 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.2590 -6.5730 0.9170 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.6260 -8.9070 1.3810 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.7730 -10.3350 -0.4350 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.5550 -9.4290 -2.7140 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.1960 -7.0980 -3.1790 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.1740 1.6520 -1.3430 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.7640 3.8230 -1.9210 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0350 4.2410 -1.8490 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.8060 3.9070 -3.4180 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 2 28 1 0 0 0 0 2 29 1 0 0 0 0 3 4 1 0 0 0 0 3 5 1 0 0 0 0 3 6 1 0 0 0 0 5 30 1 0 0 0 0 5 31 1 0 0 0 0 5 32 1 0 0 0 0 6 7 1 0 0 0 0 6 8 1 0 0 0 0 6 21 1 0 0 0 0 8 9 2 0 0 0 0 8 10 1 0 0 0 0 10 11 1 0 0 0 0 10 33 1 0 0 0 0 11 12 2 0 0 0 0 11 13 1 0 0 0 0 13 14 1 0 0 0 0 13 34 1 0 0 0 0 14 15 1 0 0 0 0 14 35 1 0 0 0 0 14 36 1 0 0 0 0 15 16 1 0 0 0 0 15 20 2 0 0 0 0 16 17 2 0 0 0 0 16 37 1 0 0 0 0 17 18 1 0 0 0 0 17 38 1 0 0 0 0 18 19 2 0 0 0 0 18 39 1 0 0 0 0 19 20 1 0 0 0 0 19 40 1 0 0 0 0 20 41 1 0 0 0 0 21 22 1 0 0 0 0 21 42 1 0 0 0 0 22 23 2 0 0 0 0 22 24 1 0 0 0 0 24 43 1 0 0 0 0 24 44 1 0 0 0 0 24 45 1 0 0 0 0 M END