PUBCHEM-ZINC05974201 MOE2007 3D CORINA 3.40 0006 02.08.2006 44 47 0 0 0 0 0 0 0 0999 V2000 0.1170 1.8230 0.0360 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0860 0.4370 0.0370 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0010 -0.4450 0.0880 C 0 0 0 0 0 0 0 0 0 0 0 0 2.2940 0.0940 0.1380 C 0 0 0 0 0 0 0 0 0 0 0 0 2.4930 1.4810 0.1380 C 0 0 0 0 0 0 0 0 0 0 0 0 1.4080 2.3680 0.0870 C 0 0 0 0 0 0 0 0 0 0 0 0 1.6250 3.8140 0.0860 C 0 0 0 0 0 0 0 0 0 0 0 0 2.7410 4.6290 0.0910 C 0 0 0 0 0 0 0 0 0 0 0 0 2.2740 5.9670 0.0840 C 0 0 0 0 0 0 0 0 0 0 0 0 0.8960 5.9040 0.0770 C 0 0 0 0 0 0 0 0 0 0 0 0 0.5000 4.5950 0.0780 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.0730 6.9470 0.0670 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.4250 6.7110 0.0790 N 0 0 0 0 0 0 0 0 0 0 0 0 -1.8500 5.7940 0.0990 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.0710 7.9200 0.0580 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.4260 8.2680 0.0560 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.7410 9.6410 0.0330 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.7100 10.5980 0.0140 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.3590 10.2200 0.0160 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.0420 8.8550 0.0390 C 0 0 0 0 0 0 0 0 0 0 0 0 0.1850 8.2380 0.0450 N 0 0 0 0 0 0 0 0 0 0 0 0 -5.1490 10.0740 0.0280 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.5540 10.9720 0.9050 N 0 3 0 0 0 0 0 0 0 0 0 0 -4.9050 11.3420 1.5910 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.5100 11.2990 0.9380 H 0 0 0 0 0 0 0 0 0 0 0 0 0.7880 -1.9000 0.0890 C 0 0 0 0 0 0 0 0 0 0 0 0 1.4540 -2.6520 -0.7650 N 0 3 0 0 0 0 0 0 0 0 0 0 2.0950 -2.2350 -1.4310 H 0 0 0 0 0 0 0 0 0 0 0 0 1.3360 -3.6560 -0.8000 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.7540 2.4740 -0.0110 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.1060 0.0610 -0.0200 H 0 0 0 0 0 0 0 0 0 0 0 0 3.1650 -0.5560 0.1950 H 0 0 0 0 0 0 0 0 0 0 0 0 3.5140 1.8550 0.1840 H 0 0 0 0 0 0 0 0 0 0 0 0 3.7740 4.3100 0.0960 H 0 0 0 0 0 0 0 0 0 0 0 0 2.8660 6.8730 0.0850 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.1960 7.5030 0.0870 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.9440 11.6610 -0.0220 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5690 10.9630 -0.0040 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.9800 9.5500 -0.8520 N 0 0 0 0 0 0 0 0 0 0 0 0 -5.6460 8.8830 -1.5390 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.9560 9.8120 -0.8900 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0700 -2.4290 0.9400 N 0 0 0 0 0 0 0 0 0 0 0 0 -0.5530 -1.8430 1.6130 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.2500 -3.4230 0.9720 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 6 2 0 0 0 0 1 30 1 0 0 0 0 2 3 2 0 0 0 0 2 31 1 0 0 0 0 3 4 1 0 0 0 0 3 26 1 0 0 0 0 4 5 2 0 0 0 0 4 32 1 0 0 0 0 5 6 1 0 0 0 0 5 33 1 0 0 0 0 6 7 1 0 0 0 0 7 8 2 0 0 0 0 7 11 1 0 0 0 0 8 9 1 0 0 0 0 8 34 1 0 0 0 0 9 10 2 0 0 0 0 9 35 1 0 0 0 0 10 11 1 0 0 0 0 10 12 1 0 0 0 0 12 13 1 0 0 0 0 12 21 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 20 2 0 0 0 0 16 17 2 0 0 0 0 16 36 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 37 1 0 0 0 0 19 20 1 0 0 0 0 19 38 1 0 0 0 0 20 21 1 0 0 0 0 22 23 2 0 0 0 0 22 39 1 0 0 0 0 23 24 1 0 0 0 0 23 25 1 0 0 0 0 26 27 2 0 0 0 0 26 42 1 0 0 0 0 27 28 1 0 0 0 0 27 29 1 0 0 0 0 39 40 1 0 0 0 0 39 41 1 0 0 0 0 42 43 1 0 0 0 0 42 44 1 0 0 0 0 M CHG 1 23 1 M CHG 1 27 1 M END