PUBCHEM-ZINC05922297 MOE2007 3D CORINA 3.40 0006 02.08.2006 43 43 0 0 1 0 0 0 0 0999 V2000 -0.9500 -0.1420 3.8880 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.2800 0.5480 2.6980 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.3520 1.0270 1.7170 C 0 0 3 0 0 0 0 0 0 0 0 0 -2.0680 1.6600 2.2410 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.6930 1.8260 0.5910 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.0500 -0.1350 1.1500 N 0 0 0 0 0 0 0 0 0 0 0 0 -3.6820 0.2000 0.9100 P 0 0 3 0 0 0 0 0 0 0 0 0 -3.8610 1.5110 -0.4020 S 0 0 0 0 0 0 0 0 0 0 0 0 -4.4410 -1.1390 0.4380 O 0 0 0 0 0 0 0 0 0 0 0 0 -3.9230 -2.0140 -0.5660 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.9450 -3.1150 -0.8590 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.3300 0.7270 2.2870 O 0 0 0 0 0 0 0 0 0 0 0 0 -5.6230 1.1280 2.1720 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.6340 0.1850 2.0550 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.9520 0.5970 1.9380 C 0 0 0 0 0 0 0 0 0 0 0 0 -8.2580 1.9510 1.9380 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.2490 2.8880 2.0540 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.9340 2.4800 2.1760 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.8570 3.4860 2.3070 N 0 3 0 0 0 0 0 0 0 0 0 0 -5.1300 4.6730 2.3110 O 0 0 0 0 0 0 0 0 0 0 0 0 -3.6980 3.1270 2.4100 O 0 5 0 0 0 0 0 0 0 0 0 0 -8.9440 -0.3250 1.8240 O 0 0 0 0 0 0 0 0 0 0 0 0 -10.2800 0.1710 1.7070 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.1860 -0.4830 4.5870 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.6140 0.5610 4.3900 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.5260 -0.9970 3.5350 H 0 0 0 0 0 0 0 0 0 0 0 0 0.2960 1.4030 3.0510 H 0 0 0 0 0 0 0 0 0 0 0 0 0.3840 -0.1550 2.1960 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.2480 2.7320 1.0010 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0820 1.2200 0.1210 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.4440 2.0940 -0.1520 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.6130 -0.4360 0.2920 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.7280 -1.4480 -1.4760 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.9960 -2.4650 -0.2120 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.1410 -3.6810 0.0510 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.8720 -2.6640 -1.2130 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.5500 -3.7820 -1.6250 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.3940 -0.8680 2.0550 H 0 0 0 0 0 0 0 0 0 0 0 0 -9.2850 2.2720 1.8470 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.4890 3.9410 2.0530 H 0 0 0 0 0 0 0 0 0 0 0 0 -10.3580 0.7980 0.8190 H 0 0 0 0 0 0 0 0 0 0 0 0 -10.9720 -0.6660 1.6230 H 0 0 0 0 0 0 0 0 0 0 0 0 -10.5270 0.7600 2.5910 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 24 1 0 0 0 0 1 25 1 0 0 0 0 1 26 1 0 0 0 0 2 3 1 0 0 0 0 2 27 1 0 0 0 0 2 28 1 0 0 0 0 3 4 1 0 0 0 0 3 5 1 0 0 0 0 3 6 1 0 0 0 0 5 29 1 0 0 0 0 5 30 1 0 0 0 0 5 31 1 0 0 0 0 6 7 1 0 0 0 0 6 32 1 0 0 0 0 7 8 2 0 0 0 0 7 9 1 0 0 0 0 7 12 1 0 0 0 0 9 10 1 0 0 0 0 10 11 1 0 0 0 0 10 33 1 0 0 0 0 10 34 1 0 0 0 0 11 35 1 0 0 0 0 11 36 1 0 0 0 0 11 37 1 0 0 0 0 12 13 1 0 0 0 0 13 14 1 0 0 0 0 13 18 2 0 0 0 0 14 15 2 0 0 0 0 14 38 1 0 0 0 0 15 16 1 0 0 0 0 15 22 1 0 0 0 0 16 17 2 0 0 0 0 16 39 1 0 0 0 0 17 18 1 0 0 0 0 17 40 1 0 0 0 0 18 19 1 0 0 0 0 19 20 2 0 0 0 0 19 21 1 0 0 0 0 22 23 1 0 0 0 0 23 41 1 0 0 0 0 23 42 1 0 0 0 0 23 43 1 0 0 0 0 M CHG 1 19 1 M CHG 1 21 -1 M END