IBS-ZINC02292212 MOE2007 3D CORINA 3.40 0006 02.08.2006 54 59 0 0 0 0 0 0 0 0999 V2000 -0.0080 1.2160 0.7980 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0550 0.2330 -0.1720 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2560 -0.3880 -0.4520 C 0 0 0 0 0 0 0 0 0 0 0 0 2.4030 -0.0230 0.2440 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3360 0.9660 1.2180 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1310 1.5820 1.4910 C 0 0 0 0 0 0 0 0 0 0 0 0 3.6200 -0.6490 -0.0360 N 0 0 0 0 0 0 0 0 0 0 0 0 4.7740 0.1000 -0.1340 C 0 0 0 0 0 0 0 0 0 0 0 0 4.7060 1.4990 -0.1190 C 0 0 0 0 0 0 0 0 0 0 0 0 5.7950 2.3430 -0.2100 C 0 0 0 0 0 0 0 0 0 0 0 0 7.1400 1.7670 -0.3330 C 0 0 0 0 0 0 0 0 0 0 0 0 7.1760 0.3090 -0.3460 C 0 0 0 0 0 0 0 0 0 0 0 0 6.0200 -0.5390 -0.2440 C 0 0 0 0 0 0 0 0 0 0 0 0 6.2520 -1.9330 -0.2690 C 0 0 0 0 0 0 0 0 0 0 0 0 5.3270 -2.7260 -0.1910 O 0 0 0 0 0 0 0 0 0 0 0 0 7.6500 -2.4020 -0.3920 C 0 0 0 0 0 0 0 0 0 0 0 0 7.9020 -3.7790 -0.4210 C 0 0 0 0 0 0 0 0 0 0 0 0 9.1910 -4.2440 -0.5340 C 0 0 0 0 0 0 0 0 0 0 0 0 10.2580 -3.3600 -0.6210 C 0 0 0 0 0 0 0 0 0 0 0 0 10.0420 -2.0020 -0.5960 C 0 0 0 0 0 0 0 0 0 0 0 0 8.7410 -1.5030 -0.4830 C 0 0 0 0 0 0 0 0 0 0 0 0 8.4910 -0.0630 -0.4650 C 0 0 0 0 0 0 0 0 0 0 0 0 9.1400 1.1060 -0.5150 O 0 0 0 0 0 0 0 0 0 0 0 0 8.3990 2.0850 -0.4430 N 0 0 0 0 0 0 0 0 0 0 0 0 5.6210 3.7120 -0.1860 N 0 0 0 0 0 0 0 0 0 0 0 0 4.2750 4.2770 -0.0640 C 0 0 0 0 0 0 0 0 0 0 0 0 4.3620 5.8050 -0.0620 C 0 0 0 0 0 0 0 0 0 0 0 0 2.9570 6.3950 0.0660 C 0 0 0 0 0 0 0 0 0 0 0 0 3.0400 7.8580 0.0670 N 0 0 0 0 0 0 0 0 0 0 0 0 2.9880 8.6750 -1.0290 C 0 0 0 0 0 0 0 0 0 0 0 0 3.1000 9.9390 -0.5790 C 0 0 0 0 0 0 0 0 0 0 0 0 3.2170 9.8950 0.7570 N 0 0 0 0 0 0 0 0 0 0 0 0 3.1750 8.6520 1.1510 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.9490 1.7030 1.0110 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.8370 -0.0510 -0.7120 H 0 0 0 0 0 0 0 0 0 0 0 0 1.3050 -1.1560 -1.2090 H 0 0 0 0 0 0 0 0 0 0 0 0 3.2250 1.2510 1.7600 H 0 0 0 0 0 0 0 0 0 0 0 0 1.0780 2.3510 2.2480 H 0 0 0 0 0 0 0 0 0 0 0 0 3.6540 -1.6100 -0.1600 H 0 0 0 0 0 0 0 0 0 0 0 0 3.7300 1.9510 -0.0290 H 0 0 0 0 0 0 0 0 0 0 0 0 7.0820 -4.4780 -0.3530 H 0 0 0 0 0 0 0 0 0 0 0 0 9.3750 -5.3080 -0.5550 H 0 0 0 0 0 0 0 0 0 0 0 0 11.2650 -3.7410 -0.7080 H 0 0 0 0 0 0 0 0 0 0 0 0 10.8770 -1.3200 -0.6640 H 0 0 0 0 0 0 0 0 0 0 0 0 6.3900 4.2990 -0.2510 H 0 0 0 0 0 0 0 0 0 0 0 0 3.6650 3.9490 -0.9050 H 0 0 0 0 0 0 0 0 0 0 0 0 3.8220 3.9380 0.8680 H 0 0 0 0 0 0 0 0 0 0 0 0 4.9720 6.1330 0.7790 H 0 0 0 0 0 0 0 0 0 0 0 0 4.8150 6.1440 -0.9940 H 0 0 0 0 0 0 0 0 0 0 0 0 2.3460 6.0670 -0.7750 H 0 0 0 0 0 0 0 0 0 0 0 0 2.5040 6.0560 0.9980 H 0 0 0 0 0 0 0 0 0 0 0 0 2.8800 8.3660 -2.0580 H 0 0 0 0 0 0 0 0 0 0 0 0 3.0970 10.8320 -1.1860 H 0 0 0 0 0 0 0 0 0 0 0 0 3.2410 8.3140 2.1750 H 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 34 1 0 0 0 0 2 3 2 0 0 0 0 2 35 1 0 0 0 0 3 4 1 0 0 0 0 3 36 1 0 0 0 0 4 5 2 0 0 0 0 4 7 1 0 0 0 0 5 6 1 0 0 0 0 5 37 1 0 0 0 0 6 38 1 0 0 0 0 7 8 1 0 0 0 0 7 39 1 0 0 0 0 8 9 1 0 0 0 0 8 13 2 0 0 0 0 9 10 2 0 0 0 0 9 40 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 11 24 2 0 0 0 0 12 13 1 0 0 0 0 12 22 2 0 0 0 0 13 14 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 2 0 0 0 0 17 18 2 0 0 0 0 17 41 1 0 0 0 0 18 19 1 0 0 0 0 18 42 1 0 0 0 0 19 20 2 0 0 0 0 19 43 1 0 0 0 0 20 21 1 0 0 0 0 20 44 1 0 0 0 0 21 22 1 0 0 0 0 22 23 1 0 0 0 0 23 24 1 0 0 0 0 25 26 1 0 0 0 0 25 45 1 0 0 0 0 26 27 1 0 0 0 0 26 46 1 0 0 0 0 26 47 1 0 0 0 0 27 28 1 0 0 0 0 27 48 1 0 0 0 0 27 49 1 0 0 0 0 28 29 1 0 0 0 0 28 50 1 0 0 0 0 28 51 1 0 0 0 0 29 30 1 0 0 0 0 29 33 1 0 0 0 0 30 31 2 0 0 0 0 30 52 1 0 0 0 0 31 32 1 0 0 0 0 31 53 1 0 0 0 0 32 33 2 0 0 0 0 33 54 1 0 0 0 0 M END