IBS-ZINC01318763 MOE2007 3D CORINA 3.40 0006 02.08.2006 52 55 0 0 1 0 0 0 0 0999 V2000 -0.8050 1.1680 0.3200 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.3740 -0.2850 0.1730 C 0 0 3 0 0 0 0 0 0 0 0 0 -1.2650 -0.9240 0.2270 H 0 0 0 0 0 0 0 0 0 0 0 0 0.6240 -0.6700 1.2750 C 0 0 0 0 0 0 0 0 0 0 0 0 1.6630 -2.2460 -0.3520 C 0 0 0 0 0 0 0 0 0 0 0 0 0.6110 -1.7940 -1.3740 C 0 0 3 0 0 0 0 0 0 0 0 0 -0.2800 -2.4330 -1.3140 H 0 0 0 0 0 0 0 0 0 0 0 0 0.2210 -0.4350 -1.1240 O 0 0 0 0 0 0 0 0 0 0 0 0 1.1680 -1.8630 -2.7890 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0110 -2.6070 2.1420 C 0 0 0 0 0 0 0 0 0 0 0 0 1.7240 -4.1090 2.2760 C 0 0 3 0 0 0 0 0 0 0 0 0 2.2310 -4.6560 1.4720 H 0 0 0 0 0 0 0 0 0 0 0 0 2.1400 -4.6300 3.6530 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0420 -6.0830 3.7160 N 0 0 0 0 0 0 0 0 0 0 0 0 3.0400 -6.9510 3.3170 C 0 0 0 0 0 0 0 0 0 0 0 0 4.3390 -6.7150 2.8320 C 0 0 0 0 0 0 0 0 0 0 0 0 5.1230 -7.8170 2.4780 C 0 0 0 0 0 0 0 0 0 0 0 0 4.6310 -9.1120 2.5980 C 0 0 0 0 0 0 0 0 0 0 0 0 3.3390 -9.3380 3.0810 C 0 0 0 0 0 0 0 0 0 0 0 0 2.5280 -8.2440 3.4510 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2010 -8.1330 3.9720 C 0 0 0 0 0 0 0 0 0 0 0 0 0.9310 -6.7760 4.1570 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.2980 -6.3290 4.6770 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.2650 -7.2840 5.0020 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.0210 -8.6390 4.8130 C 0 0 0 0 0 0 0 0 0 0 0 0 0.2060 -9.0760 4.3040 C 0 0 0 0 0 0 0 0 0 0 0 0 0.3020 -4.2490 2.0530 O 0 0 0 0 0 0 0 0 0 0 0 0 0.0880 -5.2020 2.1080 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0520 1.8430 0.2210 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.5100 1.4380 -0.4730 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.2830 1.3450 1.2880 H 0 0 0 0 0 0 0 0 0 0 0 0 1.5170 -0.0360 1.2560 H 0 0 0 0 0 0 0 0 0 0 0 0 0.1550 -0.6320 2.2640 H 0 0 0 0 0 0 0 0 0 0 0 0 1.9270 -3.2990 -0.4910 H 0 0 0 0 0 0 0 0 0 0 0 0 2.5640 -1.6240 -0.3970 H 0 0 0 0 0 0 0 0 0 0 0 0 1.4730 -2.8810 -3.0470 H 0 0 0 0 0 0 0 0 0 0 0 0 0.4160 -1.5290 -3.5120 H 0 0 0 0 0 0 0 0 0 0 0 0 2.0310 -1.1970 -2.9030 H 0 0 0 0 0 0 0 0 0 0 0 0 1.7280 -2.0830 3.0610 H 0 0 0 0 0 0 0 0 0 0 0 0 3.0520 -2.3770 1.8930 H 0 0 0 0 0 0 0 0 0 0 0 0 3.1750 -4.3570 3.8880 H 0 0 0 0 0 0 0 0 0 0 0 0 1.5060 -4.2170 4.4450 H 0 0 0 0 0 0 0 0 0 0 0 0 4.7400 -5.7120 2.7310 H 0 0 0 0 0 0 0 0 0 0 0 0 6.1340 -7.6620 2.1070 H 0 0 0 0 0 0 0 0 0 0 0 0 5.2560 -9.9570 2.3180 H 0 0 0 0 0 0 0 0 0 0 0 0 2.9650 -10.3540 3.1740 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5080 -5.2750 4.8260 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.2230 -6.9630 5.4080 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.7870 -9.3670 5.0690 H 0 0 0 0 0 0 0 0 0 0 0 0 0.3870 -10.1380 4.1670 H 0 0 0 0 0 0 0 0 0 0 0 0 1.0990 -2.0880 1.0460 N 0 3 0 0 0 0 0 0 0 0 0 0 0.2790 -2.7300 1.1420 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 29 1 0 0 0 0 1 30 1 0 0 0 0 1 31 1 0 0 0 0 2 3 1 0 0 0 0 2 4 1 0 0 0 0 2 8 1 0 0 0 0 4 32 1 0 0 0 0 4 33 1 0 0 0 0 4 51 1 0 0 0 0 5 6 1 0 0 0 0 5 34 1 0 0 0 0 5 35 1 0 0 0 0 5 51 1 0 0 0 0 6 7 1 0 0 0 0 6 8 1 0 0 0 0 6 9 1 0 0 0 0 9 36 1 0 0 0 0 9 37 1 0 0 0 0 9 38 1 0 0 0 0 10 11 1 0 0 0 0 10 39 1 0 0 0 0 10 40 1 0 0 0 0 10 51 1 0 0 0 0 11 12 1 0 0 0 0 11 13 1 0 0 0 0 11 27 1 0 0 0 0 13 14 1 0 0 0 0 13 41 1 0 0 0 0 13 42 1 0 0 0 0 14 15 1 0 0 0 0 14 22 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 43 1 0 0 0 0 17 18 1 0 0 0 0 17 44 1 0 0 0 0 18 19 2 0 0 0 0 18 45 1 0 0 0 0 19 20 1 0 0 0 0 19 46 1 0 0 0 0 20 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 23 24 1 0 0 0 0 23 47 1 0 0 0 0 24 25 2 0 0 0 0 24 48 1 0 0 0 0 25 26 1 0 0 0 0 25 49 1 0 0 0 0 26 50 1 0 0 0 0 27 28 1 0 0 0 0 51 52 1 0 0 0 0 M CHG 1 51 1 M END