PUBCHEM-ZINC02548493 MOE2007 3D CORINA 3.40 0006 02.08.2006 64 66 0 0 0 0 0 0 0 0999 V2000 -0.0190 2.1010 1.5370 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.1500 0.6250 1.2000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.5760 -0.2500 2.2200 C 0 0 0 0 0 0 0 0 0 0 0 0 0.4430 -1.7300 1.8790 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1300 -2.5650 2.8420 N 0 0 0 0 0 0 0 0 0 0 0 0 1.1590 -3.9270 2.7100 C 0 0 0 0 0 0 0 0 0 0 0 0 0.6260 -4.5420 1.7980 O 0 0 0 0 0 0 0 0 0 0 0 0 1.8860 -4.5500 3.7270 N 0 0 0 0 0 0 0 0 0 0 0 0 2.0670 -6.1990 3.9280 S 0 0 0 0 0 0 0 0 0 0 0 0 2.8490 -6.3770 5.1360 O 0 0 0 0 0 0 0 0 0 0 0 0 0.7920 -6.8690 3.7760 O 0 0 0 0 0 0 0 0 0 0 0 0 3.1050 -6.6530 2.5720 C 0 0 0 0 0 0 0 0 0 0 0 0 4.4920 -6.6010 2.7170 C 0 0 0 0 0 0 0 0 0 0 0 0 5.3100 -7.0780 1.6890 C 0 0 0 0 0 0 0 0 0 0 0 0 4.7540 -7.6250 0.5240 C 0 0 0 0 0 0 0 0 0 0 0 0 3.3560 -7.6450 0.3970 C 0 0 0 0 0 0 0 0 0 0 0 0 2.5300 -7.1640 1.4120 C 0 0 0 0 0 0 0 0 0 0 0 0 5.3070 -9.3140 -1.2810 C 0 0 0 0 0 0 0 0 0 0 0 0 6.0490 -9.5270 -2.4560 C 0 0 0 0 0 0 0 0 0 0 0 0 7.1100 -8.7080 -2.9210 C 0 0 0 0 0 0 0 0 0 0 0 0 7.7930 -9.0230 -4.0940 C 0 0 0 0 0 0 0 0 0 0 0 0 7.4280 -10.1490 -4.8180 C 0 0 0 0 0 0 0 0 0 0 0 0 6.3760 -10.9490 -4.3700 C 0 0 0 0 0 0 0 0 0 0 0 0 5.6770 -10.6560 -3.2070 C 0 0 0 0 0 0 0 0 0 0 0 0 4.6730 -11.4670 -2.8520 N 0 0 0 0 0 0 0 0 0 0 0 0 3.9970 -11.1510 -1.7430 C 0 0 0 0 0 0 0 0 0 0 0 0 4.2860 -10.1280 -0.9380 N 0 0 0 0 0 0 0 0 0 0 0 0 2.8620 -12.0340 -1.3230 C 0 0 0 0 0 0 0 0 0 0 0 0 3.3570 -12.9920 -0.2490 C 0 0 0 0 0 0 0 0 0 0 0 0 1.4220 -14.6060 -0.5900 C 0 0 0 0 0 0 0 0 0 0 0 0 2.7130 -14.6220 1.5270 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0310 2.4110 1.5460 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5460 2.7080 0.7950 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.4500 2.3190 2.5200 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.2130 0.3560 1.1680 H 0 0 0 0 0 0 0 0 0 0 0 0 0.2590 0.4470 0.1980 H 0 0 0 0 0 0 0 0 0 0 0 0 1.6380 0.0250 2.2560 H 0 0 0 0 0 0 0 0 0 0 0 0 0.1710 -0.0660 3.2230 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.6110 -2.0330 1.8640 H 0 0 0 0 0 0 0 0 0 0 0 0 0.8640 -1.9400 0.8890 H 0 0 0 0 0 0 0 0 0 0 0 0 1.5930 -2.1300 3.6270 H 0 0 0 0 0 0 0 0 0 0 0 0 2.3350 -3.9990 4.4510 H 0 0 0 0 0 0 0 0 0 0 0 0 4.9480 -6.2250 3.6290 H 0 0 0 0 0 0 0 0 0 0 0 0 6.3890 -7.0630 1.8310 H 0 0 0 0 0 0 0 0 0 0 0 0 2.8910 -8.0510 -0.4980 H 0 0 0 0 0 0 0 0 0 0 0 0 1.4500 -7.2090 1.2930 H 0 0 0 0 0 0 0 0 0 0 0 0 7.4080 -7.8110 -2.3860 H 0 0 0 0 0 0 0 0 0 0 0 0 8.6050 -8.3900 -4.4420 H 0 0 0 0 0 0 0 0 0 0 0 0 7.9530 -10.4060 -5.7340 H 0 0 0 0 0 0 0 0 0 0 0 0 6.0930 -11.8240 -4.9520 H 0 0 0 0 0 0 0 0 0 0 0 0 2.0420 -11.4130 -0.9450 H 0 0 0 0 0 0 0 0 0 0 0 0 2.4870 -12.5770 -2.1970 H 0 0 0 0 0 0 0 0 0 0 0 0 4.0660 -13.7230 -0.6550 H 0 0 0 0 0 0 0 0 0 0 0 0 3.8430 -12.4500 0.5700 H 0 0 0 0 0 0 0 0 0 0 0 0 2.1080 -15.2790 -1.1110 H 0 0 0 0 0 0 0 0 0 0 0 0 0.9150 -13.9360 -1.2870 H 0 0 0 0 0 0 0 0 0 0 0 0 0.6730 -15.1690 -0.0270 H 0 0 0 0 0 0 0 0 0 0 0 0 3.2170 -13.9660 2.2410 H 0 0 0 0 0 0 0 0 0 0 0 0 3.4010 -15.3730 1.1290 H 0 0 0 0 0 0 0 0 0 0 0 0 1.8490 -15.0920 2.0030 H 0 0 0 0 0 0 0 0 0 0 0 0 2.2140 -13.7730 0.3830 N 0 3 0 0 0 0 0 0 0 0 0 0 1.5690 -13.0820 0.7940 H 0 0 0 0 0 0 0 0 0 0 0 0 5.6020 -8.2440 -0.4140 N 0 0 0 0 0 0 0 0 0 0 0 0 6.5580 -7.9200 -0.4180 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 32 1 0 0 0 0 1 33 1 0 0 0 0 1 34 1 0 0 0 0 2 3 1 0 0 0 0 2 35 1 0 0 0 0 2 36 1 0 0 0 0 3 4 1 0 0 0 0 3 37 1 0 0 0 0 3 38 1 0 0 0 0 4 5 1 0 0 0 0 4 39 1 0 0 0 0 4 40 1 0 0 0 0 5 6 1 0 0 0 0 5 41 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 42 1 0 0 0 0 9 10 2 0 0 0 0 9 11 2 0 0 0 0 9 12 1 0 0 0 0 12 13 1 0 0 0 0 12 17 2 0 0 0 0 13 14 2 0 0 0 0 13 43 1 0 0 0 0 14 15 1 0 0 0 0 14 44 1 0 0 0 0 15 16 2 0 0 0 0 15 63 1 0 0 0 0 16 17 1 0 0 0 0 16 45 1 0 0 0 0 17 46 1 0 0 0 0 18 19 1 0 0 0 0 18 27 2 0 0 0 0 18 63 1 0 0 0 0 19 20 1 0 0 0 0 19 24 2 0 0 0 0 20 21 2 0 0 0 0 20 47 1 0 0 0 0 21 22 1 0 0 0 0 21 48 1 0 0 0 0 22 23 2 0 0 0 0 22 49 1 0 0 0 0 23 24 1 0 0 0 0 23 50 1 0 0 0 0 24 25 1 0 0 0 0 25 26 2 0 0 0 0 26 27 1 0 0 0 0 26 28 1 0 0 0 0 28 29 1 0 0 0 0 28 51 1 0 0 0 0 28 52 1 0 0 0 0 29 53 1 0 0 0 0 29 54 1 0 0 0 0 29 61 1 0 0 0 0 30 55 1 0 0 0 0 30 56 1 0 0 0 0 30 57 1 0 0 0 0 30 61 1 0 0 0 0 31 58 1 0 0 0 0 31 59 1 0 0 0 0 31 60 1 0 0 0 0 31 61 1 0 0 0 0 61 62 1 0 0 0 0 63 64 1 0 0 0 0 M CHG 1 61 1 M END