IBS-ZINC02122117 MOE2007 3D CORINA 3.40 0006 02.08.2006 47 49 0 0 1 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 -1.2950 -0.6030 0.0110 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.1540 -2.1260 0.0020 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.5430 -2.7680 0.0120 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.4080 -4.2260 0.0020 N 0 0 0 0 0 0 0 0 0 0 0 0 -3.5070 -5.0050 0.0090 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.6090 -4.4990 0.0220 O 0 0 0 0 0 0 0 0 0 0 0 0 -3.3680 -6.5060 -0.0010 C 0 0 3 0 0 0 0 0 0 0 0 0 -2.8200 -6.8030 -0.8950 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.5670 -6.9410 1.2440 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.6540 -8.1990 2.0290 S 0 0 0 0 0 0 0 0 0 0 0 0 -4.6610 -8.4820 0.5190 C 0 0 3 0 0 0 0 0 0 0 0 0 -4.2110 -9.2070 -0.1590 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.7030 -7.1060 -0.0430 N 0 0 0 0 0 0 0 0 0 0 0 0 -5.9860 -6.8700 -0.3830 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.3560 -6.0010 -1.1490 O 0 0 0 0 0 0 0 0 0 0 0 0 -6.8720 -7.8200 0.3090 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.0750 -8.8320 0.8850 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.6430 -9.8520 1.6100 C 0 0 0 0 0 0 0 0 0 0 0 0 -8.0190 -9.9160 1.7650 C 0 0 0 0 0 0 0 0 0 0 0 0 -8.8320 -8.9540 1.1910 C 0 0 0 0 0 0 0 0 0 0 0 0 -8.2620 -7.8760 0.4610 C 0 0 0 0 0 0 0 0 0 0 0 0 -9.0490 -6.9270 -0.1090 O 0 0 0 0 0 0 0 0 0 0 0 0 -9.5120 -7.1810 -1.4370 C 0 0 0 0 0 0 0 0 0 0 0 0 -10.1810 -9.0280 1.3400 O 0 0 0 0 0 0 0 0 0 0 0 0 -10.6900 -10.1240 2.1030 C 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 -1.8320 -0.2940 0.9080 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.8490 -0.2840 -0.8720 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.6170 -2.4360 -0.8950 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.6000 -2.4450 0.8850 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.0800 -2.4580 0.9080 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.0970 -2.4490 -0.8720 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.5260 -4.6320 -0.0080 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.6150 -7.3840 0.9530 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.4100 -6.0960 1.9150 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.0140 -10.6060 2.0620 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.4590 -10.7210 2.3360 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.6580 -7.2920 -2.1040 H 0 0 0 0 0 0 0 0 0 0 0 0 -10.1030 -8.0960 -1.4470 H 0 0 0 0 0 0 0 0 0 0 0 0 -10.1290 -6.3460 -1.7720 H 0 0 0 0 0 0 0 0 0 0 0 0 -11.7780 -10.0640 2.1440 H 0 0 0 0 0 0 0 0 0 0 0 0 -10.3960 -11.0620 1.6310 H 0 0 0 0 0 0 0 0 0 0 0 0 -10.2850 -10.0830 3.1140 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 28 1 0 0 0 0 1 29 1 0 0 0 0 1 30 1 0 0 0 0 2 3 1 0 0 0 0 3 4 1 0 0 0 0 3 31 1 0 0 0 0 3 32 1 0 0 0 0 4 5 1 0 0 0 0 4 33 1 0 0 0 0 4 34 1 0 0 0 0 5 6 1 0 0 0 0 5 35 1 0 0 0 0 5 36 1 0 0 0 0 6 7 1 0 0 0 0 6 37 1 0 0 0 0 7 8 2 0 0 0 0 7 9 1 0 0 0 0 9 10 1 0 0 0 0 9 11 1 0 0 0 0 9 15 1 0 0 0 0 11 12 1 0 0 0 0 11 38 1 0 0 0 0 11 39 1 0 0 0 0 12 13 1 0 0 0 0 13 14 1 0 0 0 0 13 15 1 0 0 0 0 13 19 1 0 0 0 0 15 16 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 23 2 0 0 0 0 19 20 2 0 0 0 0 20 21 1 0 0 0 0 20 40 1 0 0 0 0 21 22 2 0 0 0 0 21 41 1 0 0 0 0 22 23 1 0 0 0 0 22 26 1 0 0 0 0 23 24 1 0 0 0 0 24 25 1 0 0 0 0 25 42 1 0 0 0 0 25 43 1 0 0 0 0 25 44 1 0 0 0 0 26 27 1 0 0 0 0 27 45 1 0 0 0 0 27 46 1 0 0 0 0 27 47 1 0 0 0 0 M END