PUBCHEM-ZINC05813717 MOE2007 3D CORINA 3.40 0006 02.08.2006 49 51 0 0 1 0 0 0 0 0999 V2000 -0.7230 1.6250 0.0650 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.8460 0.2500 0.1050 C 0 0 0 0 0 0 0 0 0 0 0 0 0.2830 -0.5440 0.2160 C 0 0 0 0 0 0 0 0 0 0 0 0 1.5370 0.0380 0.2880 C 0 0 0 0 0 0 0 0 0 0 0 0 1.6650 1.4130 0.2490 C 0 0 0 0 0 0 0 0 0 0 0 0 0.5340 2.2110 0.1370 C 0 0 0 0 0 0 0 0 0 0 0 0 0.6610 3.6030 0.0960 N 0 0 0 0 0 0 0 0 0 0 0 0 2.0710 4.0060 0.1860 C 0 0 0 0 0 0 0 0 0 0 0 0 2.1610 5.5340 0.2180 C 0 0 0 0 0 0 0 0 0 0 0 0 0.1250 5.6810 -1.0820 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0340 4.1540 -1.1140 C 0 0 0 0 0 0 0 0 0 0 0 0 1.6680 7.5460 -1.0350 C 0 0 0 0 0 0 0 0 0 0 0 0 3.1000 7.9170 -1.4290 C 0 0 3 0 0 0 0 0 0 0 0 0 3.7960 7.5020 -0.7000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.2420 9.4400 -1.4610 C 0 0 0 0 0 0 0 0 0 0 0 0 4.6050 9.7860 -1.7140 O 0 0 0 0 0 0 0 0 0 0 0 0 4.9050 11.1100 -1.7750 C 0 0 0 0 0 0 0 0 0 0 0 0 6.2090 11.5170 -2.0170 C 0 0 0 0 0 0 0 0 0 0 0 0 6.5110 12.8630 -2.0790 C 0 0 0 0 0 0 0 0 0 0 0 0 5.5150 13.8050 -1.8980 C 0 0 0 0 0 0 0 0 0 0 0 0 4.2150 13.4020 -1.6560 C 0 0 0 0 0 0 0 0 0 0 0 0 3.9070 12.0570 -1.5990 C 0 0 0 0 0 0 0 0 0 0 0 0 5.8420 15.2470 -1.9630 N 0 3 0 0 0 0 0 0 0 0 0 0 6.9870 15.6040 -2.1760 O 0 0 0 0 0 0 0 0 0 0 0 0 4.9650 16.0780 -1.8040 O 0 5 0 0 0 0 0 0 0 0 0 0 3.3910 7.3840 -2.7230 O 0 0 0 0 0 0 0 0 0 0 0 0 0.1600 -1.8890 0.2560 F 0 0 0 0 0 0 0 0 0 0 0 0 -1.6040 2.2440 -0.0260 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.8240 -0.2060 0.0500 H 0 0 0 0 0 0 0 0 0 0 0 0 2.4160 -0.5830 0.3750 H 0 0 0 0 0 0 0 0 0 0 0 0 2.6430 1.8660 0.3060 H 0 0 0 0 0 0 0 0 0 0 0 0 2.5090 3.5960 1.0960 H 0 0 0 0 0 0 0 0 0 0 0 0 2.6130 3.6280 -0.6810 H 0 0 0 0 0 0 0 0 0 0 0 0 1.6430 5.9100 1.1000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.2080 5.8350 0.2560 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.3130 6.0910 -1.9920 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.4180 6.0590 -0.2150 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5530 3.7770 -1.9960 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0120 3.8520 -1.1510 H 0 0 0 0 0 0 0 0 0 0 0 0 1.4440 7.9610 -0.0520 H 0 0 0 0 0 0 0 0 0 0 0 0 0.9730 7.9540 -1.7690 H 0 0 0 0 0 0 0 0 0 0 0 0 2.6110 9.8470 -2.2510 H 0 0 0 0 0 0 0 0 0 0 0 0 2.9350 9.8540 -0.5000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.9870 10.7810 -2.1580 H 0 0 0 0 0 0 0 0 0 0 0 0 7.5260 13.1810 -2.2680 H 0 0 0 0 0 0 0 0 0 0 0 0 3.4390 14.1400 -1.5140 H 0 0 0 0 0 0 0 0 0 0 0 0 2.8900 11.7420 -1.4140 H 0 0 0 0 0 0 0 0 0 0 0 0 2.8080 7.7100 -3.4220 H 0 0 0 0 0 0 0 0 0 0 0 0 1.5350 6.0840 -0.9920 N 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 28 1 0 0 0 0 2 3 2 0 0 0 0 2 29 1 0 0 0 0 3 4 1 0 0 0 0 3 27 1 0 0 0 0 4 5 2 0 0 0 0 4 30 1 0 0 0 0 5 6 1 0 0 0 0 5 31 1 0 0 0 0 6 7 1 0 0 0 0 7 8 1 0 0 0 0 7 11 1 0 0 0 0 8 9 1 0 0 0 0 8 32 1 0 0 0 0 8 33 1 0 0 0 0 9 34 1 0 0 0 0 9 35 1 0 0 0 0 9 49 1 0 0 0 0 10 11 1 0 0 0 0 10 36 1 0 0 0 0 10 37 1 0 0 0 0 10 49 1 0 0 0 0 11 38 1 0 0 0 0 11 39 1 0 0 0 0 12 13 1 0 0 0 0 12 40 1 0 0 0 0 12 41 1 0 0 0 0 12 49 1 0 0 0 0 13 14 1 0 0 0 0 13 15 1 0 0 0 0 13 26 1 0 0 0 0 15 16 1 0 0 0 0 15 42 1 0 0 0 0 15 43 1 0 0 0 0 16 17 1 0 0 0 0 17 18 1 0 0 0 0 17 22 2 0 0 0 0 18 19 2 0 0 0 0 18 44 1 0 0 0 0 19 20 1 0 0 0 0 19 45 1 0 0 0 0 20 21 2 0 0 0 0 20 23 1 0 0 0 0 21 22 1 0 0 0 0 21 46 1 0 0 0 0 22 47 1 0 0 0 0 23 24 2 0 0 0 0 23 25 1 0 0 0 0 26 48 1 0 0 0 0 M CHG 1 23 1 M CHG 1 25 -1 M END