IBS-ZINC03904794 MOE2007 3D CORINA 3.40 0006 02.08.2006 54 57 0 0 1 0 0 0 0 0999 V2000 -0.0610 1.4400 0.6290 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0550 -0.0290 0.2060 C 0 0 3 0 0 0 0 0 0 0 0 0 -1.0770 -0.2870 -0.1020 H 0 0 0 0 0 0 0 0 0 0 0 0 0.3490 -0.9260 1.3840 C 0 0 0 0 0 0 0 0 0 0 0 0 0.4650 -2.4050 0.9890 C 0 0 3 0 0 0 0 0 0 0 0 0 0.9350 -2.9390 1.8270 H 0 0 0 0 0 0 0 0 0 0 0 0 1.3690 -2.5770 -0.2340 C 0 0 0 0 0 0 0 0 0 0 0 0 0.8820 -0.2350 -0.9840 C 0 0 0 0 0 0 0 0 0 0 0 0 1.6500 -1.9610 -2.6650 C 0 0 0 0 0 0 0 0 0 0 0 0 0.6280 -1.7730 -3.7960 C 0 0 3 0 0 0 0 0 0 0 0 0 0.4950 -0.7060 -4.0040 H 0 0 0 0 0 0 0 0 0 0 0 0 1.0530 -2.5390 -5.0510 C 0 0 0 0 0 0 0 0 0 0 0 0 0.1860 -2.2240 -6.1810 N 0 0 0 0 0 0 0 0 0 0 0 0 0.3720 -1.1520 -7.0320 C 0 0 0 0 0 0 0 0 0 0 0 0 1.3740 -0.1670 -7.0830 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2820 0.8200 -8.0680 C 0 0 0 0 0 0 0 0 0 0 0 0 0.2250 0.8310 -8.9720 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.7680 -0.1510 -8.9140 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.6970 -1.1610 -7.9320 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.5240 -2.2820 -7.6110 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.9410 -2.9430 -6.5280 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.5100 -4.1040 -5.9740 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.6980 -4.5890 -6.5290 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.3000 -3.9410 -7.6010 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.7240 -2.7920 -8.1510 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.6250 -2.2620 -3.2650 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.3090 -2.1250 -3.9530 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9110 -3.0460 0.7780 C 0 0 0 0 0 0 0 0 0 0 0 0 0.9340 1.7680 0.9460 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.3810 2.0800 -0.2000 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.7530 1.6010 1.4620 H 0 0 0 0 0 0 0 0 0 0 0 0 1.3210 -0.5940 1.7740 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.3680 -0.8130 2.2060 H 0 0 0 0 0 0 0 0 0 0 0 0 2.4050 -2.2980 -0.0070 H 0 0 0 0 0 0 0 0 0 0 0 0 1.3490 -3.6130 -0.5900 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5300 0.3270 -1.8550 H 0 0 0 0 0 0 0 0 0 0 0 0 1.9120 0.0650 -0.7550 H 0 0 0 0 0 0 0 0 0 0 0 0 1.9890 -3.0020 -2.6300 H 0 0 0 0 0 0 0 0 0 0 0 0 2.5160 -1.2970 -2.7390 H 0 0 0 0 0 0 0 0 0 0 0 0 2.0790 -2.2900 -5.3410 H 0 0 0 0 0 0 0 0 0 0 0 0 1.0130 -3.6210 -4.8910 H 0 0 0 0 0 0 0 0 0 0 0 0 2.2060 -0.1600 -6.3870 H 0 0 0 0 0 0 0 0 0 0 0 0 2.0480 1.5900 -8.1310 H 0 0 0 0 0 0 0 0 0 0 0 0 0.1710 1.6070 -9.7320 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.5880 -0.1340 -9.6260 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0560 -4.6210 -5.1340 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.1560 -5.4850 -6.1160 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.2240 -4.3320 -8.0180 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.2010 -2.2970 -8.9920 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.4700 -2.5840 -0.0410 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.8060 -4.1120 0.5500 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.5170 -2.9600 1.6860 H 0 0 0 0 0 0 0 0 0 0 0 0 0.9110 -1.6930 -1.3610 N 0 3 0 0 0 0 0 0 0 0 0 0 -0.0590 -1.9770 -1.6270 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 5 1 0 0 0 0 4 32 1 0 0 0 0 4 33 1 0 0 0 0 5 6 1 0 0 0 0 5 7 1 0 0 0 0 5 28 1 0 0 0 0 7 34 1 0 0 0 0 7 35 1 0 0 0 0 7 53 1 0 0 0 0 8 36 1 0 0 0 0 8 37 1 0 0 0 0 8 53 1 0 0 0 0 9 10 1 0 0 0 0 9 38 1 0 0 0 0 9 39 1 0 0 0 0 9 53 1 0 0 0 0 10 11 1 0 0 0 0 10 12 1 0 0 0 0 10 26 1 0 0 0 0 12 13 1 0 0 0 0 12 40 1 0 0 0 0 12 41 1 0 0 0 0 13 14 1 0 0 0 0 13 21 1 0 0 0 0 14 15 1 0 0 0 0 14 19 2 0 0 0 0 15 16 2 0 0 0 0 15 42 1 0 0 0 0 16 17 1 0 0 0 0 16 43 1 0 0 0 0 17 18 2 0 0 0 0 17 44 1 0 0 0 0 18 19 1 0 0 0 0 18 45 1 0 0 0 0 19 20 1 0 0 0 0 20 21 1 0 0 0 0 20 25 2 0 0 0 0 21 22 2 0 0 0 0 22 23 1 0 0 0 0 22 46 1 0 0 0 0 23 24 2 0 0 0 0 23 47 1 0 0 0 0 24 25 1 0 0 0 0 24 48 1 0 0 0 0 25 49 1 0 0 0 0 26 27 1 0 0 0 0 28 50 1 0 0 0 0 28 51 1 0 0 0 0 28 52 1 0 0 0 0 53 54 1 0 0 0 0 M CHG 1 53 1 M END