NCID-ZINC05518615 MOE2007 3D CORINA 3.40 0006 02.08.2006 70 70 0 0 1 0 0 0 0 0999 V2000 0.5500 -1.0190 -1.2050 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.2520 -0.6330 0.0400 C 0 0 3 0 0 0 0 0 0 0 0 0 -0.6920 0.3540 -0.1030 H 0 0 0 0 0 0 0 0 0 0 0 0 0.6750 -0.6070 1.2570 C 0 0 3 0 0 0 0 0 0 0 0 0 1.4730 0.1160 1.0900 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.1130 -0.2130 2.4800 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.5170 -1.0660 3.2410 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.3680 1.0870 2.7270 N 0 0 0 0 0 0 0 0 0 0 0 0 -1.2230 1.4640 3.8550 C 0 0 3 0 0 0 0 0 0 0 0 0 -1.9630 0.6830 4.0280 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.9350 2.7830 3.5390 C 0 0 3 0 0 0 0 0 0 0 0 0 -2.6090 3.0380 4.3560 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.8880 3.8890 3.3730 C 0 0 3 0 0 0 0 0 0 0 0 0 -1.3890 4.8420 3.2030 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0430 3.9750 4.6470 C 0 0 3 0 0 0 0 0 0 0 0 0 -0.6800 4.2460 5.4880 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5660 2.7080 4.9000 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.3650 1.6430 5.1100 C 0 0 3 0 0 0 0 0 0 0 0 0 -1.0070 1.8840 5.9580 H 0 0 0 0 0 0 0 0 0 0 0 0 0.3560 0.4120 5.3830 O 0 0 0 0 0 0 0 0 0 0 0 0 0.9940 0.3280 6.5610 C 0 0 0 0 0 0 0 0 0 0 0 0 0.9510 1.2520 7.3380 O 0 0 0 0 0 0 0 0 0 0 0 0 1.7640 -0.9180 6.9140 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0440 5.0370 4.4670 C 0 0 0 0 0 0 0 0 0 0 0 0 1.7700 5.2030 5.7140 O 0 0 0 0 0 0 0 0 0 0 0 0 2.7640 6.1040 5.7250 C 0 0 0 0 0 0 0 0 0 0 0 0 3.0190 6.7340 4.7260 O 0 0 0 0 0 0 0 0 0 0 0 0 3.5620 6.3310 6.9830 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0320 3.5810 2.2420 O 0 0 0 0 0 0 0 0 0 0 0 0 0.4900 4.6210 1.5720 C 0 0 0 0 0 0 0 0 0 0 0 0 0.2410 5.7500 1.9200 O 0 0 0 0 0 0 0 0 0 0 0 0 1.3880 4.3790 0.3860 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.6940 2.6430 2.3090 O 0 0 0 0 0 0 0 0 0 0 0 0 -3.8070 3.3840 2.1920 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.1360 4.1260 3.0870 O 0 0 0 0 0 0 0 0 0 0 0 0 -4.6460 3.2920 0.9440 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2550 -1.9380 1.4570 N 0 0 0 0 0 0 0 0 0 0 0 0 2.3640 -2.2980 0.7810 C 0 0 0 0 0 0 0 0 0 0 0 0 2.8830 -1.5200 0.0060 O 0 0 0 0 0 0 0 0 0 0 0 0 2.8970 -3.5220 0.9660 N 0 0 0 0 0 0 0 0 0 0 0 0 4.1030 -3.9130 0.2310 C 0 0 0 0 0 0 0 0 0 0 0 0 5.3420 -3.5320 1.0440 C 0 0 0 0 0 0 0 0 0 0 0 0 6.8260 -4.0140 0.1400 Cl 0 0 0 0 0 0 0 0 0 0 0 0 2.3460 -4.3480 1.7880 N 0 0 0 0 0 0 0 0 0 0 0 0 2.8280 -5.4540 1.9550 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.2910 -1.5910 0.2520 O 0 0 0 0 0 0 0 0 0 0 0 0 0.9000 -2.0470 -1.1070 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0840 -0.9340 -2.0870 H 0 0 0 0 0 0 0 0 0 0 0 0 1.4060 -0.3520 -1.3070 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0150 1.7730 2.1580 H 0 0 0 0 0 0 0 0 0 0 0 0 2.7930 -0.8190 6.5700 H 0 0 0 0 0 0 0 0 0 0 0 0 1.7530 -1.0580 7.9950 H 0 0 0 0 0 0 0 0 0 0 0 0 1.3010 -1.7800 6.4320 H 0 0 0 0 0 0 0 0 0 0 0 0 1.7340 4.7220 3.6840 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5840 5.9840 4.1860 H 0 0 0 0 0 0 0 0 0 0 0 0 3.1890 5.6780 7.7720 H 0 0 0 0 0 0 0 0 0 0 0 0 4.6120 6.1090 6.7930 H 0 0 0 0 0 0 0 0 0 0 0 0 3.4610 7.3710 7.2940 H 0 0 0 0 0 0 0 0 0 0 0 0 0.7870 4.3310 -0.5210 H 0 0 0 0 0 0 0 0 0 0 0 0 2.1080 5.1930 0.3030 H 0 0 0 0 0 0 0 0 0 0 0 0 1.9200 3.4370 0.5190 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.3980 2.5120 1.0680 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.1390 4.2470 0.7660 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.0080 3.0480 0.0940 H 0 0 0 0 0 0 0 0 0 0 0 0 0.8400 -2.5590 2.0760 H 0 0 0 0 0 0 0 0 0 0 0 0 4.0940 -4.9910 0.0660 H 0 0 0 0 0 0 0 0 0 0 0 0 4.1260 -3.3990 -0.7300 H 0 0 0 0 0 0 0 0 0 0 0 0 5.3510 -2.4540 1.2090 H 0 0 0 0 0 0 0 0 0 0 0 0 5.3180 -4.0460 2.0050 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.8420 -1.4090 1.0270 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 47 1 0 0 0 0 1 48 1 0 0 0 0 1 49 1 0 0 0 0 2 3 1 0 0 0 0 2 4 1 0 0 0 0 2 46 1 0 0 0 0 4 5 1 0 0 0 0 4 6 1 0 0 0 0 4 37 1 0 0 0 0 6 7 2 0 0 0 0 6 8 1 0 0 0 0 8 9 1 0 0 0 0 8 50 1 0 0 0 0 9 10 1 0 0 0 0 9 11 1 0 0 0 0 9 18 1 0 0 0 0 11 12 1 0 0 0 0 11 13 1 0 0 0 0 11 33 1 0 0 0 0 13 14 1 0 0 0 0 13 15 1 0 0 0 0 13 29 1 0 0 0 0 15 16 1 0 0 0 0 15 17 1 0 0 0 0 15 24 1 0 0 0 0 17 18 1 0 0 0 0 18 19 1 0 0 0 0 18 20 1 0 0 0 0 20 21 1 0 0 0 0 21 22 2 0 0 0 0 21 23 1 0 0 0 0 23 51 1 0 0 0 0 23 52 1 0 0 0 0 23 53 1 0 0 0 0 24 25 1 0 0 0 0 24 54 1 0 0 0 0 24 55 1 0 0 0 0 25 26 1 0 0 0 0 26 27 2 0 0 0 0 26 28 1 0 0 0 0 28 56 1 0 0 0 0 28 57 1 0 0 0 0 28 58 1 0 0 0 0 29 30 1 0 0 0 0 30 31 2 0 0 0 0 30 32 1 0 0 0 0 32 59 1 0 0 0 0 32 60 1 0 0 0 0 32 61 1 0 0 0 0 33 34 1 0 0 0 0 34 35 2 0 0 0 0 34 36 1 0 0 0 0 36 62 1 0 0 0 0 36 63 1 0 0 0 0 36 64 1 0 0 0 0 37 38 1 0 0 0 0 37 65 1 0 0 0 0 38 39 2 0 0 0 0 38 40 1 0 0 0 0 40 41 1 0 0 0 0 40 44 1 0 0 0 0 41 42 1 0 0 0 0 41 66 1 0 0 0 0 41 67 1 0 0 0 0 42 43 1 0 0 0 0 42 68 1 0 0 0 0 42 69 1 0 0 0 0 44 45 2 0 0 0 0 46 70 1 0 0 0 0 M END