IBS-ZINC05348270 MOE2007 3D CORINA 3.40 0006 02.08.2006 55 58 0 0 0 0 0 0 0 0999 V2000 -0.0190 1.5260 0.0100 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0020 -0.0040 0.0020 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.3720 -0.5110 0.0120 N 0 0 0 0 0 0 0 0 0 0 0 0 -2.1080 -0.7730 -1.0940 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.3410 -1.2310 -0.7320 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.3620 -1.2520 0.7430 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.0990 -0.7960 1.1520 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.8100 -0.7090 2.5100 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.7590 -1.0720 3.4400 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.0100 -1.5280 3.0360 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.3160 -1.6120 1.6900 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.9350 -1.8840 3.9660 O 0 0 0 0 0 0 0 0 0 0 0 0 -4.5550 -1.7640 5.3380 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.4320 -1.6250 -1.6320 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.5190 -2.7770 -2.0140 O 0 0 0 0 0 0 0 0 0 0 0 0 -5.3360 -0.7110 -2.0360 N 0 0 0 0 0 0 0 0 0 0 0 0 -6.4360 -1.0850 -2.9380 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.7540 -0.5980 -2.3260 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.6520 0.8380 -2.0320 N 0 0 0 0 0 0 0 0 0 0 0 0 -6.6140 1.1040 -1.0280 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.2530 0.6850 -1.5820 C 0 0 0 0 0 0 0 0 0 0 0 0 -8.8860 1.3550 -1.6250 C 0 0 0 0 0 0 0 0 0 0 0 0 -9.0040 2.7000 -1.2990 C 0 0 0 0 0 0 0 0 0 0 0 0 -10.2240 3.2080 -0.8980 C 0 0 0 0 0 0 0 0 0 0 0 0 -11.3290 2.3780 -0.8210 C 0 0 0 0 0 0 0 0 0 0 0 0 -11.2150 1.0370 -1.1450 C 0 0 0 0 0 0 0 0 0 0 0 0 -9.9980 0.5250 -1.5520 C 0 0 0 0 0 0 0 0 0 0 0 0 -12.5220 2.8770 -0.4280 F 0 0 0 0 0 0 0 0 0 0 0 0 -1.6360 -0.5860 -2.5130 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0040 1.9030 0.0030 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5460 1.8870 -0.8730 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5290 1.8770 0.9070 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5120 -0.3560 -0.8950 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5290 -0.3650 0.8850 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.8420 -0.3570 2.8350 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.5300 -1.0030 4.4940 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.2870 -1.9670 1.3760 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.3830 -2.0800 5.9730 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.6880 -2.3960 5.5310 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.3050 -0.7260 5.5560 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.2890 -0.6150 -3.9100 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.4640 -2.1680 -3.0520 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.5680 -0.7680 -3.0310 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.9510 -1.1450 -1.4040 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.6000 2.1680 -0.7920 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.8270 0.5330 -0.1240 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.4980 0.7710 -0.8000 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.9890 1.3280 -2.4210 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.1420 3.3480 -1.3590 H 0 0 0 0 0 0 0 0 0 0 0 0 -10.3160 4.2540 -0.6440 H 0 0 0 0 0 0 0 0 0 0 0 0 -12.0780 0.3910 -1.0840 H 0 0 0 0 0 0 0 0 0 0 0 0 -9.9100 -0.5200 -1.8090 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.1660 -1.5050 -2.8640 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.4870 -0.3460 -3.1510 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9130 0.2290 -2.5510 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 30 1 0 0 0 0 1 31 1 0 0 0 0 1 32 1 0 0 0 0 2 3 1 0 0 0 0 2 33 1 0 0 0 0 2 34 1 0 0 0 0 3 4 1 0 0 0 0 3 7 1 0 0 0 0 4 5 2 0 0 0 0 4 29 1 0 0 0 0 5 6 1 0 0 0 0 5 14 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 8 9 1 0 0 0 0 8 35 1 0 0 0 0 9 10 2 0 0 0 0 9 36 1 0 0 0 0 10 11 1 0 0 0 0 10 12 1 0 0 0 0 11 37 1 0 0 0 0 12 13 1 0 0 0 0 13 38 1 0 0 0 0 13 39 1 0 0 0 0 13 40 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 21 1 0 0 0 0 17 18 1 0 0 0 0 17 41 1 0 0 0 0 17 42 1 0 0 0 0 18 19 1 0 0 0 0 18 43 1 0 0 0 0 18 44 1 0 0 0 0 19 20 1 0 0 0 0 19 22 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 47 1 0 0 0 0 21 48 1 0 0 0 0 22 23 1 0 0 0 0 22 27 2 0 0 0 0 23 24 2 0 0 0 0 23 49 1 0 0 0 0 24 25 1 0 0 0 0 24 50 1 0 0 0 0 25 26 2 0 0 0 0 25 28 1 0 0 0 0 26 27 1 0 0 0 0 26 51 1 0 0 0 0 27 52 1 0 0 0 0 29 53 1 0 0 0 0 29 54 1 0 0 0 0 29 55 1 0 0 0 0 M END