PUBCHEM-ZINC05563695 MOE2007 3D CORINA 3.40 0006 02.08.2006 49 51 0 0 0 0 0 0 0 0999 V2000 -0.3350 1.2000 -0.4740 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0140 -0.2490 -0.1270 C 0 0 0 0 0 0 0 0 0 0 0 0 0.7630 -0.2860 1.1800 C 0 0 0 0 0 0 0 0 0 0 0 0 0.1140 -0.4040 2.2970 N 0 0 0 0 0 0 0 0 0 0 0 0 0.8110 -0.6100 3.4950 N 0 0 0 0 0 0 0 0 0 0 0 0 0.1480 -0.6130 4.6690 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.0520 -0.4370 4.6880 O 0 0 0 0 0 0 0 0 0 0 0 0 0.8980 -0.8350 5.9570 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0400 -0.7920 7.0810 N 0 3 0 0 0 0 0 0 0 0 0 0 -0.2990 0.2550 7.8090 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.2180 -0.0690 8.7640 N 0 0 0 0 0 0 0 0 0 0 0 0 -1.5830 0.5290 9.4350 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.5300 -1.3820 8.6050 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.7790 -1.8360 7.5270 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.9220 -3.2350 7.1220 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.2830 -3.6800 6.1860 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.7780 -4.0210 7.8100 N 0 0 0 0 0 0 0 0 0 0 0 0 -2.4840 -3.5340 8.8430 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.2440 -4.2750 9.4360 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.3740 -2.2570 9.2500 N 0 0 0 0 0 0 0 0 0 0 0 0 -3.1730 -1.7870 10.3840 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.9390 -5.4250 7.4230 C 0 0 0 0 0 0 0 0 0 0 0 0 2.2340 -0.1890 1.1900 C 0 0 0 0 0 0 0 0 0 0 0 0 2.8820 0.5370 2.1930 C 0 0 0 0 0 0 0 0 0 0 0 0 4.2570 0.6250 2.1980 C 0 0 0 0 0 0 0 0 0 0 0 0 4.9990 -0.0060 1.2080 C 0 0 0 0 0 0 0 0 0 0 0 0 4.3600 -0.7280 0.2090 C 0 0 0 0 0 0 0 0 0 0 0 0 2.9850 -0.8270 0.1990 C 0 0 0 0 0 0 0 0 0 0 0 0 6.3550 0.0840 1.2160 O 0 0 0 0 0 0 0 0 0 0 0 0 0.5810 1.7830 -0.5630 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.8770 1.2270 -1.4190 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9590 1.6220 0.3150 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9020 -0.8320 -0.0370 H 0 0 0 0 0 0 0 0 0 0 0 0 0.6380 -0.6710 -0.9150 H 0 0 0 0 0 0 0 0 0 0 0 0 1.7700 -0.7510 3.4790 H 0 0 0 0 0 0 0 0 0 0 0 0 1.3890 -1.8080 5.9290 H 0 0 0 0 0 0 0 0 0 0 0 0 1.6480 -0.0530 6.0800 H 0 0 0 0 0 0 0 0 0 0 0 0 0.1440 1.2310 7.6770 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.1310 -1.4130 10.0230 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.3440 -2.6130 11.0760 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.6410 -0.9870 10.8980 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.2210 -6.0370 7.9690 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.9510 -5.7540 7.6610 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.7650 -5.5300 6.3520 H 0 0 0 0 0 0 0 0 0 0 0 0 2.3060 1.0290 2.9630 H 0 0 0 0 0 0 0 0 0 0 0 0 4.7590 1.1860 2.9730 H 0 0 0 0 0 0 0 0 0 0 0 0 4.9410 -1.2180 -0.5590 H 0 0 0 0 0 0 0 0 0 0 0 0 2.4890 -1.3920 -0.5760 H 0 0 0 0 0 0 0 0 0 0 0 0 6.7920 -0.6180 1.7170 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 30 1 0 0 0 0 1 31 1 0 0 0 0 1 32 1 0 0 0 0 2 3 1 0 0 0 0 2 33 1 0 0 0 0 2 34 1 0 0 0 0 3 4 2 0 0 0 0 3 23 1 0 0 0 0 4 5 1 0 0 0 0 5 6 1 0 0 0 0 5 35 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 36 1 0 0 0 0 8 37 1 0 0 0 0 9 10 2 0 0 0 0 9 14 1 0 0 0 0 10 11 1 0 0 0 0 10 38 1 0 0 0 0 11 12 1 0 0 0 0 11 13 1 0 0 0 0 13 14 2 0 0 0 0 13 20 1 0 0 0 0 14 15 1 0 0 0 0 15 16 2 0 0 0 0 15 17 1 0 0 0 0 17 18 1 0 0 0 0 17 22 1 0 0 0 0 18 19 2 0 0 0 0 18 20 1 0 0 0 0 20 21 1 0 0 0 0 21 39 1 0 0 0 0 21 40 1 0 0 0 0 21 41 1 0 0 0 0 22 42 1 0 0 0 0 22 43 1 0 0 0 0 22 44 1 0 0 0 0 23 24 1 0 0 0 0 23 28 2 0 0 0 0 24 25 2 0 0 0 0 24 45 1 0 0 0 0 25 26 1 0 0 0 0 25 46 1 0 0 0 0 26 27 2 0 0 0 0 26 29 1 0 0 0 0 27 28 1 0 0 0 0 27 47 1 0 0 0 0 28 48 1 0 0 0 0 29 49 1 0 0 0 0 M CHG 1 9 1 M END