IBS-ZINC00703020 MOE2007 3D CORINA 3.40 0006 02.08.2006 55 59 0 0 1 0 0 0 0 0999 V2000 -0.0330 1.1670 -0.3070 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0330 0.3300 0.7990 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2500 -0.0960 1.2860 C 0 0 0 0 0 0 0 0 0 0 0 0 2.4250 0.3120 0.6670 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3540 1.1600 -0.4550 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1080 1.5810 -0.9320 C 0 0 0 0 0 0 0 0 0 0 0 0 3.6910 1.3990 -0.8590 C 0 0 0 0 0 0 0 0 0 0 0 0 4.4940 0.7120 0.0020 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7290 0.0660 0.9090 O 0 0 0 0 0 0 0 0 0 0 0 0 5.9550 0.6780 -0.0490 C 0 0 0 0 0 0 0 0 0 0 0 0 6.6520 1.8280 -0.1860 O 0 0 0 0 0 0 0 0 0 0 0 0 6.6230 -0.5320 0.0440 C 0 0 0 0 0 0 0 0 0 0 0 0 6.0520 -1.8100 0.0510 C 0 0 0 0 0 0 0 0 0 0 0 0 7.1480 -2.8090 0.1660 C 0 0 0 0 0 0 0 0 0 0 0 0 6.9920 -4.0120 0.1990 O 0 0 0 0 0 0 0 0 0 0 0 0 8.3360 -2.1840 0.2260 N 0 0 0 0 0 0 0 0 0 0 0 0 8.1170 -0.7370 0.1500 C 0 0 3 0 0 0 0 0 0 0 0 0 8.6140 -0.3280 -0.7300 H 0 0 0 0 0 0 0 0 0 0 0 0 8.6420 -0.0720 1.3960 C 0 0 0 0 0 0 0 0 0 0 0 0 9.2850 1.1540 1.3210 C 0 0 0 0 0 0 0 0 0 0 0 0 9.7520 1.7280 2.4930 C 0 0 0 0 0 0 0 0 0 0 0 0 9.5620 1.0640 3.6900 C 0 0 0 0 0 0 0 0 0 0 0 0 8.9450 -0.1020 3.7250 N 0 0 0 0 0 0 0 0 0 0 0 0 8.4830 -0.6740 2.6300 C 0 0 0 0 0 0 0 0 0 0 0 0 9.6390 -2.8430 0.3440 C 0 0 0 0 0 0 0 0 0 0 0 0 10.1950 -3.1270 -1.0530 C 0 0 0 0 0 0 0 0 0 0 0 0 12.1740 -3.8620 -2.2410 C 0 0 0 0 0 0 0 0 0 0 0 0 13.5530 -4.5020 -2.0630 C 0 0 0 0 0 0 0 0 0 0 0 0 13.4020 -5.7890 -1.4570 O 0 0 0 0 0 0 0 0 0 0 0 0 12.7510 -5.7530 -0.1840 C 0 0 0 0 0 0 0 0 0 0 0 0 11.3640 -5.1260 -0.3430 C 0 0 0 0 0 0 0 0 0 0 0 0 4.8620 -2.0610 -0.0230 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.9950 1.4890 -0.6780 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.8780 0.0110 1.2840 H 0 0 0 0 0 0 0 0 0 0 0 0 1.2910 -0.7460 2.1480 H 0 0 0 0 0 0 0 0 0 0 0 0 1.0490 2.2320 -1.7920 H 0 0 0 0 0 0 0 0 0 0 0 0 4.0130 2.0090 -1.6910 H 0 0 0 0 0 0 0 0 0 0 0 0 9.4200 1.6500 0.3710 H 0 0 0 0 0 0 0 0 0 0 0 0 10.2580 2.6820 2.4710 H 0 0 0 0 0 0 0 0 0 0 0 0 9.9220 1.5040 4.6080 H 0 0 0 0 0 0 0 0 0 0 0 0 7.9790 -1.6270 2.6980 H 0 0 0 0 0 0 0 0 0 0 0 0 10.3280 -2.1940 0.8840 H 0 0 0 0 0 0 0 0 0 0 0 0 9.5240 -3.7820 0.8860 H 0 0 0 0 0 0 0 0 0 0 0 0 9.5060 -3.7770 -1.5930 H 0 0 0 0 0 0 0 0 0 0 0 0 10.3100 -2.1880 -1.5960 H 0 0 0 0 0 0 0 0 0 0 0 0 12.2880 -2.8580 -2.6500 H 0 0 0 0 0 0 0 0 0 0 0 0 11.5770 -4.4680 -2.9240 H 0 0 0 0 0 0 0 0 0 0 0 0 14.0320 -4.6120 -3.0360 H 0 0 0 0 0 0 0 0 0 0 0 0 14.1680 -3.8690 -1.4230 H 0 0 0 0 0 0 0 0 0 0 0 0 12.6500 -6.7680 0.2020 H 0 0 0 0 0 0 0 0 0 0 0 0 13.3430 -5.1560 0.5100 H 0 0 0 0 0 0 0 0 0 0 0 0 10.7540 -5.7520 -0.9950 H 0 0 0 0 0 0 0 0 0 0 0 0 10.8870 -5.0450 0.6340 H 0 0 0 0 0 0 0 0 0 0 0 0 7.6110 1.7050 -0.2090 H 0 0 0 0 0 0 0 0 0 0 0 0 11.5020 -3.7880 -0.9360 N 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 6 2 0 0 0 0 1 33 1 0 0 0 0 2 3 2 0 0 0 0 2 34 1 0 0 0 0 3 4 1 0 0 0 0 3 35 1 0 0 0 0 4 5 2 0 0 0 0 4 9 1 0 0 0 0 5 6 1 0 0 0 0 5 7 1 0 0 0 0 6 36 1 0 0 0 0 7 8 2 0 0 0 0 7 37 1 0 0 0 0 8 9 1 0 0 0 0 8 10 1 0 0 0 0 10 11 1 0 0 0 0 10 12 2 0 0 0 0 11 54 1 0 0 0 0 12 13 1 0 0 0 0 12 17 1 0 0 0 0 13 14 1 0 0 0 0 13 32 2 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 25 1 0 0 0 0 17 18 1 0 0 0 0 17 19 1 0 0 0 0 19 20 1 0 0 0 0 19 24 2 0 0 0 0 20 21 2 0 0 0 0 20 38 1 0 0 0 0 21 22 1 0 0 0 0 21 39 1 0 0 0 0 22 23 2 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 25 26 1 0 0 0 0 25 42 1 0 0 0 0 25 43 1 0 0 0 0 26 44 1 0 0 0 0 26 45 1 0 0 0 0 26 55 1 0 0 0 0 27 28 1 0 0 0 0 27 46 1 0 0 0 0 27 47 1 0 0 0 0 27 55 1 0 0 0 0 28 29 1 0 0 0 0 28 48 1 0 0 0 0 28 49 1 0 0 0 0 29 30 1 0 0 0 0 30 31 1 0 0 0 0 30 50 1 0 0 0 0 30 51 1 0 0 0 0 31 52 1 0 0 0 0 31 53 1 0 0 0 0 31 55 1 0 0 0 0 M END