PUBCHEM-ZINC04559806 MOE2007 3D CORINA 3.40 0006 02.08.2006 47 48 0 0 0 0 0 0 0 0999 V2000 0.3920 1.0420 0.8370 C 0 0 0 0 0 0 0 0 0 0 0 0 0.8040 -0.3280 0.2690 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3510 -0.4030 0.3790 C 0 0 0 0 0 0 0 0 0 0 0 0 0.2290 -1.5320 1.0780 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.8690 -1.2470 1.9850 N 0 0 0 0 0 0 0 0 0 0 0 0 -2.1540 -0.9950 1.5560 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.4190 -0.8670 0.3590 O 0 0 0 0 0 0 0 0 0 0 0 0 -3.1800 -0.8550 2.6660 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.4290 -1.6160 2.3630 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.6910 -1.0820 2.1870 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.5610 -2.1070 1.9300 N 0 0 0 0 0 0 0 0 0 0 0 0 -7.5530 -2.0010 1.7640 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.8940 -3.3090 1.9290 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.5540 -3.0360 2.2090 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.6480 -4.1160 2.2790 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.1110 -5.4190 2.0600 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.4530 -5.6560 1.7760 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.3720 -4.6050 1.7070 C 0 0 0 0 0 0 0 0 0 0 0 0 0.4820 -0.4520 -1.2480 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.4190 0.9560 -2.1190 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.4100 -1.4860 -2.5290 C 0 0 0 0 0 0 0 0 0 0 0 0 0.8660 1.8560 0.2770 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.6880 1.2080 0.7950 H 0 0 0 0 0 0 0 0 0 0 0 0 0.7000 1.1430 1.8840 H 0 0 0 0 0 0 0 0 0 0 0 0 2.6800 -0.3060 1.4200 H 0 0 0 0 0 0 0 0 0 0 0 0 2.7300 -1.3580 -0.0040 H 0 0 0 0 0 0 0 0 0 0 0 0 2.8310 0.3990 -0.1950 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.1020 -2.3300 0.4020 H 0 0 0 0 0 0 0 0 0 0 0 0 1.0060 -1.9760 1.7120 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.6700 -1.2530 2.9800 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.7660 -1.2080 3.6180 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.3920 0.2150 2.7830 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.0440 -0.0600 2.2230 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.5990 -3.9480 2.5000 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.4160 -6.2540 2.1150 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.7950 -6.6750 1.6080 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.4190 -4.7960 1.4910 H 0 0 0 0 0 0 0 0 0 0 0 0 0.9890 0.3310 -1.8270 H 0 0 0 0 0 0 0 0 0 0 0 0 0.8610 -1.4130 -1.6210 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9260 1.1300 -3.0800 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.1380 1.7240 -1.3970 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.5060 0.9400 -2.2370 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.1850 -2.4430 -2.0500 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.8610 -1.3770 -3.4680 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.4880 -1.4010 -2.6930 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9870 -0.3840 -1.5950 N 0 3 0 0 0 0 0 0 0 0 0 0 -1.5660 -0.5550 -0.7280 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 22 1 0 0 0 0 1 23 1 0 0 0 0 1 24 1 0 0 0 0 2 3 1 0 0 0 0 2 4 1 0 0 0 0 2 19 1 0 0 0 0 3 25 1 0 0 0 0 3 26 1 0 0 0 0 3 27 1 0 0 0 0 4 5 1 0 0 0 0 4 28 1 0 0 0 0 4 29 1 0 0 0 0 5 6 1 0 0 0 0 5 30 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 31 1 0 0 0 0 8 32 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 33 1 0 0 0 0 11 12 1 0 0 0 0 11 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 15 16 1 0 0 0 0 15 34 1 0 0 0 0 16 17 2 0 0 0 0 16 35 1 0 0 0 0 17 18 1 0 0 0 0 17 36 1 0 0 0 0 18 37 1 0 0 0 0 19 38 1 0 0 0 0 19 39 1 0 0 0 0 19 46 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 20 46 1 0 0 0 0 21 43 1 0 0 0 0 21 44 1 0 0 0 0 21 45 1 0 0 0 0 21 46 1 0 0 0 0 46 47 1 0 0 0 0 M CHG 1 46 1 M END