IBS-ZINC05556891 MOE2007 3D CORINA 3.40 0006 02.08.2006 49 52 0 0 0 0 0 0 0 0999 V2000 0.8050 0.7240 2.8060 C 0 0 0 0 0 0 0 0 0 0 0 0 0.4880 -0.3560 1.9860 C 0 0 0 0 0 0 0 0 0 0 0 0 1.4950 -1.0250 1.2890 C 0 0 0 0 0 0 0 0 0 0 0 0 2.8330 -0.6180 1.4090 C 0 0 0 0 0 0 0 0 0 0 0 0 3.1410 0.4670 2.2440 C 0 0 0 0 0 0 0 0 0 0 0 0 2.1300 1.1340 2.9380 C 0 0 0 0 0 0 0 0 0 0 0 0 3.9160 -1.3210 0.6370 C 0 0 0 0 0 0 0 0 0 0 0 0 4.7840 -1.9650 -1.6240 C 0 0 0 0 0 0 0 0 0 0 0 0 4.7240 -1.6390 -3.1240 C 0 0 0 0 0 0 0 0 0 0 0 0 4.2430 0.6850 -2.6580 C 0 0 0 0 0 0 0 0 0 0 0 0 4.2910 0.4330 -1.1430 C 0 0 0 0 0 0 0 0 0 0 0 0 5.0840 0.0280 -4.8530 C 0 0 0 0 0 0 0 0 0 0 0 0 5.9340 1.1980 -5.3180 C 0 0 0 0 0 0 0 0 0 0 0 0 6.8700 1.7770 -4.5530 C 0 0 0 0 0 0 0 0 0 0 0 0 7.6850 2.9210 -4.9690 C 0 0 0 0 0 0 0 0 0 0 0 0 8.5210 3.4050 -4.2170 O 0 0 0 0 0 0 0 0 0 0 0 0 7.4510 3.4260 -6.2410 O 0 0 0 0 0 0 0 0 0 0 0 0 6.5050 2.8280 -7.0950 C 0 0 0 0 0 0 0 0 0 0 0 0 5.7430 1.7270 -6.6840 C 0 0 0 0 0 0 0 0 0 0 0 0 4.8410 1.1820 -7.6100 C 0 0 0 0 0 0 0 0 0 0 0 0 4.7090 1.7400 -8.8870 C 0 0 0 0 0 0 0 0 0 0 0 0 5.4780 2.8420 -9.2590 C 0 0 0 0 0 0 0 0 0 0 0 0 6.3840 3.3930 -8.3660 C 0 0 0 0 0 0 0 0 0 0 0 0 5.3790 3.4140 -10.4960 O 0 0 0 0 0 0 0 0 0 0 0 0 3.5840 1.0470 -9.9950 Cl 0 0 0 0 0 0 0 0 0 0 0 0 0.0200 1.2440 3.3490 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5470 -0.6780 1.8940 H 0 0 0 0 0 0 0 0 0 0 0 0 1.2220 -1.8710 0.6620 H 0 0 0 0 0 0 0 0 0 0 0 0 4.1680 0.8050 2.3640 H 0 0 0 0 0 0 0 0 0 0 0 0 2.3750 1.9730 3.5850 H 0 0 0 0 0 0 0 0 0 0 0 0 4.9150 -1.0770 1.0190 H 0 0 0 0 0 0 0 0 0 0 0 0 3.7780 -2.4050 0.7380 H 0 0 0 0 0 0 0 0 0 0 0 0 4.4060 -2.9760 -1.4380 H 0 0 0 0 0 0 0 0 0 0 0 0 5.8030 -1.8750 -1.2320 H 0 0 0 0 0 0 0 0 0 0 0 0 5.4050 -2.3260 -3.6410 H 0 0 0 0 0 0 0 0 0 0 0 0 3.7110 -1.8360 -3.5020 H 0 0 0 0 0 0 0 0 0 0 0 0 3.2050 0.5960 -3.0040 H 0 0 0 0 0 0 0 0 0 0 0 0 4.5520 1.7220 -2.8320 H 0 0 0 0 0 0 0 0 0 0 0 0 5.2960 0.6000 -0.7370 H 0 0 0 0 0 0 0 0 0 0 0 0 3.5740 1.0850 -0.6360 H 0 0 0 0 0 0 0 0 0 0 0 0 4.0390 0.1650 -5.1570 H 0 0 0 0 0 0 0 0 0 0 0 0 5.4600 -0.8510 -5.3940 H 0 0 0 0 0 0 0 0 0 0 0 0 7.0840 1.4230 -3.5510 H 0 0 0 0 0 0 0 0 0 0 0 0 4.2310 0.3180 -7.3640 H 0 0 0 0 0 0 0 0 0 0 0 0 6.9890 4.2470 -8.6540 H 0 0 0 0 0 0 0 0 0 0 0 0 4.7130 2.9150 -11.0040 H 0 0 0 0 0 0 0 0 0 0 0 0 3.9070 -1.0050 -0.8430 N 0 3 0 0 0 0 0 0 0 0 0 0 2.9410 -1.1340 -1.1690 H 0 0 0 0 0 0 0 0 0 0 0 0 5.1180 -0.2460 -3.4010 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 26 1 0 0 0 0 2 3 2 0 0 0 0 2 27 1 0 0 0 0 3 4 1 0 0 0 0 3 28 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 29 1 0 0 0 0 6 30 1 0 0 0 0 7 31 1 0 0 0 0 7 32 1 0 0 0 0 7 47 1 0 0 0 0 8 9 1 0 0 0 0 8 33 1 0 0 0 0 8 34 1 0 0 0 0 8 47 1 0 0 0 0 9 35 1 0 0 0 0 9 36 1 0 0 0 0 9 49 1 0 0 0 0 10 11 1 0 0 0 0 10 37 1 0 0 0 0 10 38 1 0 0 0 0 10 49 1 0 0 0 0 11 39 1 0 0 0 0 11 40 1 0 0 0 0 11 47 1 0 0 0 0 12 13 1 0 0 0 0 12 41 1 0 0 0 0 12 42 1 0 0 0 0 12 49 1 0 0 0 0 13 14 2 0 0 0 0 13 19 1 0 0 0 0 14 15 1 0 0 0 0 14 43 1 0 0 0 0 15 16 2 0 0 0 0 15 17 1 0 0 0 0 17 18 1 0 0 0 0 18 19 1 0 0 0 0 18 23 2 0 0 0 0 19 20 2 0 0 0 0 20 21 1 0 0 0 0 20 44 1 0 0 0 0 21 22 2 0 0 0 0 21 25 1 0 0 0 0 22 23 1 0 0 0 0 22 24 1 0 0 0 0 23 45 1 0 0 0 0 24 46 1 0 0 0 0 47 48 1 0 0 0 0 M CHG 1 47 1 M END