IBS-ZINC05353309 MOE2007 3D CORINA 3.40 0006 02.08.2006 48 49 0 0 0 0 0 0 0 0999 V2000 0.2220 1.1570 -0.0010 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0280 -0.3500 0.0160 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.3810 -0.7220 0.0050 N 0 0 0 0 0 0 0 0 0 0 0 0 -2.1480 -0.9460 -1.1250 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.4550 -1.1840 -0.7010 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.4360 -1.2040 0.7340 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.1390 -0.9020 1.1460 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.7960 -0.8200 2.5070 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.7870 -1.0630 3.4670 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.0890 -1.3740 3.0870 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.4180 -1.4390 1.7250 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.1330 -1.6310 3.9370 O 0 0 0 0 0 0 0 0 0 0 0 0 -4.8460 -1.6360 5.3310 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.6300 -1.4190 -1.5370 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.5270 -2.1970 -1.2210 O 0 0 0 0 0 0 0 0 0 0 0 0 -4.6980 -0.6520 -2.6870 N 0 0 0 0 0 0 0 0 0 0 0 0 -5.7670 -0.8260 -3.6510 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.0930 -0.2130 -3.1810 C 0 0 0 0 0 0 0 0 0 0 0 0 -9.5750 -0.3300 -3.3640 C 0 0 0 0 0 0 0 0 0 0 0 0 -8.2240 -0.2300 -5.4470 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.5580 -0.9380 -2.4980 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2880 1.4020 0.0100 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.2220 1.6040 -0.8960 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.2440 1.6260 0.8720 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5210 -0.8100 -0.8450 H 0 0 0 0 0 0 0 0 0 0 0 0 0.4910 -0.7890 0.9050 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.7860 -0.5770 2.8260 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.4980 -0.9990 4.5120 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.4370 -1.6820 1.4320 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.7710 -1.8820 5.8610 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.1050 -2.4030 5.5800 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.5220 -0.6460 5.6690 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.9790 0.0430 -2.8540 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.4330 -0.3590 -4.5830 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.8840 -1.9010 -3.8310 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.3090 -0.5070 -2.1480 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.0700 0.8810 -3.2310 H 0 0 0 0 0 0 0 0 0 0 0 0 -9.6490 0.7590 -3.3160 H 0 0 0 0 0 0 0 0 0 0 0 0 -9.5910 -0.7710 -2.3630 H 0 0 0 0 0 0 0 0 0 0 0 0 -10.3840 -0.7530 -3.9650 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.3270 -0.6390 -5.9170 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.2130 0.8630 -5.4580 H 0 0 0 0 0 0 0 0 0 0 0 0 -9.1100 -0.6170 -5.9570 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.6330 -1.5200 -2.5380 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.2300 -1.3930 -3.2310 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.3450 0.0870 -2.8160 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.2660 -0.6940 -4.0180 N 0 3 0 0 0 0 0 0 0 0 0 0 -8.2320 -1.7240 -4.0210 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 22 1 0 0 0 0 1 23 1 0 0 0 0 1 24 1 0 0 0 0 2 3 1 0 0 0 0 2 25 1 0 0 0 0 2 26 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 21 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 27 1 0 0 0 0 9 10 2 0 0 0 0 9 28 1 0 0 0 0 10 11 1 0 0 0 0 10 12 1 0 0 0 0 11 29 1 0 0 0 0 12 13 1 0 0 0 0 13 30 1 0 0 0 0 13 31 1 0 0 0 0 13 32 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 33 1 0 0 0 0 17 18 1 0 0 0 0 17 34 1 0 0 0 0 17 35 1 0 0 0 0 18 36 1 0 0 0 0 18 37 1 0 0 0 0 18 47 1 0 0 0 0 19 38 1 0 0 0 0 19 39 1 0 0 0 0 19 40 1 0 0 0 0 19 47 1 0 0 0 0 20 41 1 0 0 0 0 20 42 1 0 0 0 0 20 43 1 0 0 0 0 20 47 1 0 0 0 0 21 44 1 0 0 0 0 21 45 1 0 0 0 0 21 46 1 0 0 0 0 47 48 1 0 0 0 0 M CHG 1 47 1 M END