PUBCHEM-ZINC01530737 MOE2007 3D CORINA 3.40 0006 02.08.2006 42 42 0 0 0 0 0 0 0 0999 V2000 -1.1170 -0.7610 -2.5220 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.5410 -1.0950 -1.2180 N 0 0 0 0 0 0 0 0 0 0 0 0 -1.1340 -0.6210 -0.0540 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.5570 -0.8410 1.1240 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.2530 -0.4550 2.3730 N 0 3 0 0 0 0 0 0 0 0 0 0 -2.3920 -0.0260 2.3280 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.6860 -0.5660 3.4460 O 0 5 0 0 0 0 0 0 0 0 0 0 -2.3310 0.0810 -0.1210 N 0 0 0 0 0 0 0 0 0 0 0 0 -2.3200 1.5450 -0.1720 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.7560 2.0690 -0.1150 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.7420 3.8820 -0.1780 S 0 0 0 0 0 0 0 0 0 0 0 0 -5.5030 4.3070 -0.1020 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.6610 5.8050 -0.1450 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.7950 6.4850 -1.2870 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.9490 8.1940 -0.8860 S 0 0 0 0 0 0 0 0 0 0 0 0 -5.8190 7.8240 0.7780 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.6840 6.5510 0.9410 N 0 0 0 0 0 0 0 0 0 0 0 0 -5.8620 8.8370 1.8930 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.9550 10.0630 1.0420 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.4690 10.1130 3.4070 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.4710 -1.1420 -3.3130 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.1050 -1.2120 -2.6100 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.2030 0.3220 -2.6150 H 0 0 0 0 0 0 0 0 0 0 0 0 0.2550 -1.6470 -1.1660 H 0 0 0 0 0 0 0 0 0 0 0 0 0.4200 -1.3000 1.1700 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.1750 -0.3980 -0.1340 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.7580 1.9340 0.6770 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.8500 1.8730 -1.0990 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.3180 1.6800 -0.9650 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.2260 1.7420 0.8120 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.0220 3.8630 -0.9510 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.9300 3.9240 0.8250 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.8060 6.0620 -2.2810 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.4840 9.6810 1.5930 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.2810 8.3760 2.7870 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.5900 10.9270 0.8410 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.9250 9.4220 0.1610 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.9470 10.4010 1.2800 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.8120 9.5080 4.2460 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.1220 10.9780 3.2920 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.4490 10.4500 3.5950 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.5000 9.3090 2.1780 N 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 21 1 0 0 0 0 1 22 1 0 0 0 0 1 23 1 0 0 0 0 2 3 1 0 0 0 0 2 24 1 0 0 0 0 3 4 2 0 0 0 0 3 8 1 0 0 0 0 4 5 1 0 0 0 0 4 25 1 0 0 0 0 5 6 2 0 0 0 0 5 7 1 0 0 0 0 8 9 1 0 0 0 0 8 26 1 0 0 0 0 9 10 1 0 0 0 0 9 27 1 0 0 0 0 9 28 1 0 0 0 0 10 11 1 0 0 0 0 10 29 1 0 0 0 0 10 30 1 0 0 0 0 11 12 1 0 0 0 0 12 13 1 0 0 0 0 12 31 1 0 0 0 0 12 32 1 0 0 0 0 13 14 2 0 0 0 0 13 17 1 0 0 0 0 14 15 1 0 0 0 0 14 33 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 34 1 0 0 0 0 18 35 1 0 0 0 0 18 42 1 0 0 0 0 19 36 1 0 0 0 0 19 37 1 0 0 0 0 19 38 1 0 0 0 0 19 42 1 0 0 0 0 20 39 1 0 0 0 0 20 40 1 0 0 0 0 20 41 1 0 0 0 0 20 42 1 0 0 0 0 M CHG 1 5 1 M CHG 1 7 -1 M END