IBS-ZINC02345411 MOE2007 3D CORINA 3.40 0006 02.08.2006 42 43 0 0 0 0 0 0 0 0999 V2000 0.2730 0.7180 0.3030 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0370 -0.5870 -0.1200 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0870 -1.3560 -0.6200 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3770 -0.8200 -0.6950 C 0 0 0 0 0 0 0 0 0 0 0 0 2.6340 0.4920 -0.2640 C 0 0 0 0 0 0 0 0 0 0 0 0 1.5610 1.2550 0.2290 C 0 0 0 0 0 0 0 0 0 0 0 0 4.0070 1.1210 -0.3380 C 0 0 0 0 0 0 0 0 0 0 0 0 4.3860 1.6100 -1.7240 C 0 0 0 0 0 0 0 0 0 0 0 0 3.5850 1.7770 -2.6430 O 0 0 0 0 0 0 0 0 0 0 0 0 5.7360 1.8840 -1.8410 N 0 0 0 0 0 0 0 0 0 0 0 0 6.2160 2.3930 -3.0430 N 0 0 0 0 0 0 0 0 0 0 0 0 7.5730 2.6160 -3.1540 C 0 0 0 0 0 0 0 0 0 0 0 0 8.3760 2.3510 -2.2640 O 0 0 0 0 0 0 0 0 0 0 0 0 7.9520 3.1840 -4.4550 C 0 0 0 0 0 0 0 0 0 0 0 0 8.9810 4.0220 -4.6160 C 0 0 0 0 0 0 0 0 0 0 0 0 9.2080 4.4840 -5.8980 O 0 0 0 0 0 0 0 0 0 0 0 0 9.7500 4.5700 -3.6280 N 0 0 0 0 0 0 0 0 0 0 0 0 11.0610 5.1020 -3.6140 C 0 0 0 0 0 0 0 0 0 0 0 0 11.9740 4.8980 -4.6610 C 0 0 0 0 0 0 0 0 0 0 0 0 13.2450 5.4770 -4.6280 C 0 0 0 0 0 0 0 0 0 0 0 0 13.6240 6.2670 -3.5480 C 0 0 0 0 0 0 0 0 0 0 0 0 12.7380 6.4710 -2.4910 C 0 0 0 0 0 0 0 0 0 0 0 0 11.4560 5.8920 -2.5050 C 0 0 0 0 0 0 0 0 0 0 0 0 10.5160 6.1020 -1.3320 C 0 0 0 0 0 0 0 0 0 0 0 0 9.4120 5.4600 -1.3770 O 0 5 0 0 0 0 0 0 0 0 0 0 3.6280 -1.8310 -1.3290 Cl 0 0 0 0 0 0 0 0 0 0 0 0 -0.5450 1.3210 0.6880 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9650 -1.0040 -0.0650 H 0 0 0 0 0 0 0 0 0 0 0 0 0.8920 -2.3720 -0.9520 H 0 0 0 0 0 0 0 0 0 0 0 0 1.7210 2.2810 0.5570 H 0 0 0 0 0 0 0 0 0 0 0 0 4.0600 1.9840 0.3380 H 0 0 0 0 0 0 0 0 0 0 0 0 4.7600 0.4130 0.0270 H 0 0 0 0 0 0 0 0 0 0 0 0 6.4260 1.7490 -1.1030 H 0 0 0 0 0 0 0 0 0 0 0 0 5.5300 2.5810 -3.7700 H 0 0 0 0 0 0 0 0 0 0 0 0 7.3690 2.8800 -5.3170 H 0 0 0 0 0 0 0 0 0 0 0 0 9.6900 5.3170 -5.7490 H 0 0 0 0 0 0 0 0 0 0 0 0 9.3260 4.6320 -2.6650 H 0 0 0 0 0 0 0 0 0 0 0 0 11.7190 4.2570 -5.5000 H 0 0 0 0 0 0 0 0 0 0 0 0 13.9410 5.3030 -5.4440 H 0 0 0 0 0 0 0 0 0 0 0 0 14.6120 6.7170 -3.5200 H 0 0 0 0 0 0 0 0 0 0 0 0 13.0450 7.0800 -1.6430 H 0 0 0 0 0 0 0 0 0 0 0 0 10.8900 6.8850 -0.4050 O 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 27 1 0 0 0 0 2 3 2 0 0 0 0 2 28 1 0 0 0 0 3 4 1 0 0 0 0 3 29 1 0 0 0 0 4 5 2 0 0 0 0 4 26 1 0 0 0 0 5 6 1 0 0 0 0 5 7 1 0 0 0 0 6 30 1 0 0 0 0 7 8 1 0 0 0 0 7 31 1 0 0 0 0 7 32 1 0 0 0 0 8 9 2 0 0 0 0 8 10 1 0 0 0 0 10 11 1 0 0 0 0 10 33 1 0 0 0 0 11 12 1 0 0 0 0 11 34 1 0 0 0 0 12 13 2 0 0 0 0 12 14 1 0 0 0 0 14 15 2 0 0 0 0 14 35 1 0 0 0 0 15 16 1 0 0 0 0 15 17 1 0 0 0 0 16 36 1 0 0 0 0 17 18 1 0 0 0 0 17 37 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 19 38 1 0 0 0 0 20 21 1 0 0 0 0 20 39 1 0 0 0 0 21 22 2 0 0 0 0 21 40 1 0 0 0 0 22 23 1 0 0 0 0 22 41 1 0 0 0 0 23 24 1 0 0 0 0 24 25 1 0 0 0 0 24 42 2 0 0 0 0 M CHG 1 25 -1 M END