PUBCHEM-ZINC04158356 MOE2007 3D CORINA 3.40 0006 02.08.2006 47 50 0 0 1 0 0 0 0 0999 V2000 -1.8040 1.9160 1.5680 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.4220 0.4990 1.2280 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.1740 -0.4110 2.2380 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.8230 -1.7120 1.9270 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.7200 -2.1020 0.6050 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.9680 -1.1920 -0.4060 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.3230 0.1080 -0.0940 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.2710 -3.7590 0.2080 S 0 0 0 0 0 0 0 0 0 0 0 0 0.2810 -3.7220 -1.1010 O 0 0 0 0 0 0 0 0 0 0 0 0 0.4320 -4.2650 1.3340 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.6730 -4.6340 0.1000 N 0 0 0 0 0 0 0 0 0 0 0 0 -2.4430 -4.6750 -1.1550 C 0 0 3 0 0 0 0 0 0 0 0 0 -2.1210 -3.8690 -1.8140 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.9020 -4.4960 -0.8000 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.3730 -4.5530 0.4640 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.8050 -4.3400 0.3920 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.8060 -4.2940 1.3670 C 0 0 0 0 0 0 0 0 0 0 0 0 -8.0870 -4.0650 0.9300 C 0 0 0 0 0 0 0 0 0 0 0 0 -8.3860 -3.8860 -0.4110 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.4160 -3.9260 -1.3960 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.1050 -4.1580 -0.9820 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.9310 -4.2580 -1.6720 N 0 0 0 0 0 0 0 0 0 0 0 0 -4.8400 -4.1730 -2.6340 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.5260 -4.7910 1.6880 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.1780 -5.3940 1.2530 C 0 0 3 0 0 0 0 0 0 0 0 0 -2.3170 -6.4370 0.9700 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.1910 -5.3040 2.3880 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.1160 -4.2920 3.0450 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.2370 -6.0240 -1.8470 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.9040 2.5260 1.6480 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.4460 2.3180 0.7830 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.3390 1.9310 2.5170 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.2550 -0.1070 3.2720 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.6300 -2.4230 2.7160 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.8870 -1.4960 -1.4390 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.5200 0.8180 -0.8840 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.5820 -4.4330 2.4140 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.8870 -4.0230 1.6540 H 0 0 0 0 0 0 0 0 0 0 0 0 -9.4130 -3.7090 -0.6970 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.6620 -3.7850 -2.4380 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.3550 -3.8460 2.2030 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.0360 -5.4850 2.3560 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.5760 -6.8250 -1.1900 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.8090 -6.0480 -2.7740 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.1780 -6.1610 -2.0690 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.3960 -6.3470 2.6700 O 0 0 0 0 0 0 0 0 0 0 0 0 0.2210 -6.2420 3.4070 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 30 1 0 0 0 0 1 31 1 0 0 0 0 1 32 1 0 0 0 0 2 3 1 0 0 0 0 2 7 2 0 0 0 0 3 4 2 0 0 0 0 3 33 1 0 0 0 0 4 5 1 0 0 0 0 4 34 1 0 0 0 0 5 6 2 0 0 0 0 5 8 1 0 0 0 0 6 7 1 0 0 0 0 6 35 1 0 0 0 0 7 36 1 0 0 0 0 8 9 2 0 0 0 0 8 10 2 0 0 0 0 8 11 1 0 0 0 0 11 12 1 0 0 0 0 11 25 1 0 0 0 0 12 13 1 0 0 0 0 12 14 1 0 0 0 0 12 29 1 0 0 0 0 14 15 2 0 0 0 0 14 22 1 0 0 0 0 15 16 1 0 0 0 0 15 24 1 0 0 0 0 16 17 1 0 0 0 0 16 21 2 0 0 0 0 17 18 2 0 0 0 0 17 37 1 0 0 0 0 18 19 1 0 0 0 0 18 38 1 0 0 0 0 19 20 2 0 0 0 0 19 39 1 0 0 0 0 20 21 1 0 0 0 0 20 40 1 0 0 0 0 21 22 1 0 0 0 0 22 23 1 0 0 0 0 24 25 1 0 0 0 0 24 41 1 0 0 0 0 24 42 1 0 0 0 0 25 26 1 0 0 0 0 25 27 1 0 0 0 0 27 28 2 0 0 0 0 27 46 1 0 0 0 0 29 43 1 0 0 0 0 29 44 1 0 0 0 0 29 45 1 0 0 0 0 46 47 1 0 0 0 0 M END