IBS-ZINC02449802 MOE2007 3D CORINA 3.40 0006 02.08.2006 42 44 0 0 0 0 0 0 0 0999 V2000 -0.0170 1.4250 0.0100 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0020 -0.0040 0.0020 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.2000 -0.6380 0.0100 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.2550 -2.0240 0.0030 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.4790 -2.6650 0.0110 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.6480 -1.9270 0.0260 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.5960 -0.5450 0.0330 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.3740 0.1010 0.0310 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.9810 -2.6290 0.0350 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.4120 -2.8710 1.4590 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.1180 -2.0680 2.1900 N 0 0 0 0 0 0 0 0 0 0 0 0 -6.3760 -2.4540 3.3640 N 0 0 0 0 0 0 0 0 0 0 0 0 -5.9160 -3.6100 3.7340 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.0520 -4.3010 2.4270 S 0 0 0 0 0 0 0 0 0 0 0 0 -6.0990 -4.1940 4.9830 N 0 0 0 0 0 0 0 0 0 0 0 0 -6.8080 -3.5490 5.9310 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.2860 -2.4600 5.6950 O 0 0 0 0 0 0 0 0 0 0 0 0 -7.0060 -4.1820 7.2850 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.7840 -3.3100 8.1080 O 0 0 0 0 0 0 0 0 0 0 0 0 -8.0560 -3.7340 9.3700 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.5840 -4.9630 9.8080 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.8620 -5.3920 11.0910 C 0 0 0 0 0 0 0 0 0 0 0 0 -8.6100 -4.5980 11.9400 C 0 0 0 0 0 0 0 0 0 0 0 0 -9.0830 -3.3730 11.5080 C 0 0 0 0 0 0 0 0 0 0 0 0 -8.8030 -2.9360 10.2260 C 0 0 0 0 0 0 0 0 0 0 0 0 -9.3890 -1.3940 9.6860 Cl 0 0 0 0 0 0 0 0 0 0 0 0 1.0050 1.8020 0.0020 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5440 1.7860 -0.8730 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5280 1.7760 0.9070 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.3430 -2.6010 -0.0090 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.5220 -3.7440 0.0060 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.5100 0.0290 0.0440 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.3340 1.1800 0.0410 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.7220 -2.0080 -0.4680 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.8930 -3.5830 -0.4840 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.7170 -5.0650 5.1720 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.5260 -5.1320 7.1690 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.0360 -4.3520 7.7520 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.0000 -5.5840 9.1450 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.4940 -6.3490 11.4320 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.8260 -4.9350 12.9430 H 0 0 0 0 0 0 0 0 0 0 0 0 -9.6680 -2.7540 12.1730 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 27 1 0 0 0 0 1 28 1 0 0 0 0 1 29 1 0 0 0 0 2 3 1 0 0 0 0 3 4 1 0 0 0 0 3 8 2 0 0 0 0 4 5 2 0 0 0 0 4 30 1 0 0 0 0 5 6 1 0 0 0 0 5 31 1 0 0 0 0 6 7 2 0 0 0 0 6 9 1 0 0 0 0 7 8 1 0 0 0 0 7 32 1 0 0 0 0 8 33 1 0 0 0 0 9 10 1 0 0 0 0 9 34 1 0 0 0 0 9 35 1 0 0 0 0 10 11 2 0 0 0 0 10 14 1 0 0 0 0 11 12 1 0 0 0 0 12 13 2 0 0 0 0 13 14 1 0 0 0 0 13 15 1 0 0 0 0 15 16 1 0 0 0 0 15 36 1 0 0 0 0 16 17 2 0 0 0 0 16 18 1 0 0 0 0 18 19 1 0 0 0 0 18 37 1 0 0 0 0 18 38 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 21 39 1 0 0 0 0 22 23 1 0 0 0 0 22 40 1 0 0 0 0 23 24 2 0 0 0 0 23 41 1 0 0 0 0 24 25 1 0 0 0 0 24 42 1 0 0 0 0 25 26 1 0 0 0 0 M END