PUBCHEM-ZINC04461082 MOE2007 3D CORINA 3.40 0006 02.08.2006 57 58 0 0 1 0 0 0 0 0999 V2000 -4.6490 1.7330 -5.2390 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.9490 0.4480 -4.7920 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.9020 -0.3760 -3.9240 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.2020 -1.6610 -3.4770 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.1560 -2.4860 -2.6100 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.4560 -3.7710 -2.1630 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.3950 -4.5830 -1.3090 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.5140 -4.1740 -1.0800 O 0 0 0 0 0 0 0 0 0 0 0 0 -4.9920 -5.7640 -0.7990 N 0 0 0 0 0 0 0 0 0 0 0 0 -5.8110 -6.5390 0.1300 C 0 0 3 0 0 0 0 0 0 0 0 0 -6.4400 -7.2310 -0.4310 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.8900 -7.3400 1.0920 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.5890 -7.8780 -0.0970 S 0 0 0 0 0 0 0 0 0 0 0 0 -3.6960 -6.3710 -1.1400 C 0 0 3 0 0 0 0 0 0 0 0 0 -2.8820 -5.6870 -0.9000 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.6590 -6.7380 -2.6010 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.4580 -6.7280 -3.2860 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.4240 -7.0650 -4.6260 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.5900 -7.4130 -5.2810 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.7910 -7.4240 -4.5960 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.8240 -7.0910 -3.2550 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.6820 -5.6060 0.9310 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.2540 -4.5320 1.2820 O 0 0 0 0 0 0 0 0 0 0 0 0 -7.9340 -5.9680 1.2540 O 0 0 0 0 0 0 0 0 0 0 0 0 -8.7160 -5.0190 2.0270 C 0 0 0 0 0 0 0 0 0 0 0 0 -10.1040 -5.6020 2.2960 C 0 0 0 0 0 0 0 0 0 0 0 0 -10.9280 -4.6020 3.1110 C 0 0 0 0 0 0 0 0 0 0 0 0 -12.3160 -5.1850 3.3800 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.9700 2.3210 -5.8570 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.5380 1.4810 -5.8160 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.9370 2.3140 -4.3620 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.6610 -0.1320 -5.6680 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.0590 0.7010 -4.2150 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.1900 0.2040 -3.0480 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.7920 -0.6290 -4.5010 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.9140 -2.2420 -4.3540 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.3130 -1.4090 -2.9000 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.4440 -1.9050 -1.7340 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.0450 -2.7390 -3.1870 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.1680 -4.3520 -3.0390 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.5660 -3.5180 -1.5860 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.4760 -6.6990 1.8700 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.4120 -8.1940 1.5220 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.5470 -6.4560 -2.7740 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.4860 -7.0560 -5.1620 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.5640 -7.6760 -6.3290 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.7020 -7.6960 -5.1080 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.7620 -7.1040 -2.7190 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.2140 -4.8220 2.9740 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.8140 -4.0880 1.4670 H 0 0 0 0 0 0 0 0 0 0 0 0 -10.6060 -5.7990 1.3490 H 0 0 0 0 0 0 0 0 0 0 0 0 -10.0050 -6.5320 2.8560 H 0 0 0 0 0 0 0 0 0 0 0 0 -10.4260 -4.4050 4.0580 H 0 0 0 0 0 0 0 0 0 0 0 0 -11.0260 -3.6720 2.5510 H 0 0 0 0 0 0 0 0 0 0 0 0 -12.8180 -5.3820 2.4330 H 0 0 0 0 0 0 0 0 0 0 0 0 -12.2170 -6.1160 3.9400 H 0 0 0 0 0 0 0 0 0 0 0 0 -12.9030 -4.4730 3.9600 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 29 1 0 0 0 0 1 30 1 0 0 0 0 1 31 1 0 0 0 0 2 3 1 0 0 0 0 2 32 1 0 0 0 0 2 33 1 0 0 0 0 3 4 1 0 0 0 0 3 34 1 0 0 0 0 3 35 1 0 0 0 0 4 5 1 0 0 0 0 4 36 1 0 0 0 0 4 37 1 0 0 0 0 5 6 1 0 0 0 0 5 38 1 0 0 0 0 5 39 1 0 0 0 0 6 7 1 0 0 0 0 6 40 1 0 0 0 0 6 41 1 0 0 0 0 7 8 2 0 0 0 0 7 9 1 0 0 0 0 9 10 1 0 0 0 0 9 14 1 0 0 0 0 10 11 1 0 0 0 0 10 12 1 0 0 0 0 10 22 1 0 0 0 0 12 13 1 0 0 0 0 12 42 1 0 0 0 0 12 43 1 0 0 0 0 13 14 1 0 0 0 0 14 15 1 0 0 0 0 14 16 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 44 1 0 0 0 0 18 19 1 0 0 0 0 18 45 1 0 0 0 0 19 20 2 0 0 0 0 19 46 1 0 0 0 0 20 21 1 0 0 0 0 20 47 1 0 0 0 0 21 48 1 0 0 0 0 22 23 2 0 0 0 0 22 24 1 0 0 0 0 24 25 1 0 0 0 0 25 26 1 0 0 0 0 25 49 1 0 0 0 0 25 50 1 0 0 0 0 26 27 1 0 0 0 0 26 51 1 0 0 0 0 26 52 1 0 0 0 0 27 28 1 0 0 0 0 27 53 1 0 0 0 0 27 54 1 0 0 0 0 28 55 1 0 0 0 0 28 56 1 0 0 0 0 28 57 1 0 0 0 0 M END