PUBCHEM-ZINC04455382 MOE2007 3D CORINA 3.40 0006 02.08.2006 50 50 0 0 0 0 0 0 0 0999 V2000 -0.0190 1.5260 0.0100 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0020 -0.0040 0.0020 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.3390 -0.4990 0.0120 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.4320 -1.9250 0.0050 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.9050 -2.3390 0.0170 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.0050 -3.8660 0.0100 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.4150 -4.2630 0.0210 N 0 0 0 0 0 0 0 0 0 0 0 0 -5.1320 -4.4550 -1.2420 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.9930 -5.8880 -1.6860 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.3580 -6.6720 -1.0130 O 0 0 0 0 0 0 0 0 0 0 0 0 -5.5750 -6.2980 -2.8300 N 0 0 0 0 0 0 0 0 0 0 0 0 -5.4470 -7.6200 -3.2400 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.9650 -8.1170 -4.3190 N 0 0 0 0 0 0 0 0 0 0 0 0 -5.7430 -9.3960 -4.5550 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.0020 -10.0100 -3.6310 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.5770 -8.8270 -2.3960 S 0 0 0 0 0 0 0 0 0 0 0 0 -6.2820 -10.1060 -5.7700 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.0520 -4.4520 1.1940 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.2200 -4.7800 1.2030 O 0 0 0 0 0 0 0 0 0 0 0 0 -4.3150 -4.2550 2.4930 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.2610 -4.5300 3.6630 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.4820 -4.4520 4.9780 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.3800 -3.4870 3.6710 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0040 1.9030 0.0030 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5460 1.8870 -0.8730 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5290 1.8770 0.9070 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5120 -0.3560 -0.8950 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5290 -0.3650 0.8850 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9520 -2.3160 -0.8910 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9350 -2.3260 0.8880 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.3850 -1.9480 0.9140 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.4020 -1.9380 -0.8660 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.5240 -4.2570 -0.8870 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.5070 -4.2670 0.8930 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.1870 -4.2190 -1.1000 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.7120 -3.7960 -2.0020 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.0840 -5.6710 -3.3680 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.7100 -11.0500 -3.6400 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.5600 -10.0340 -6.5840 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.4560 -11.1550 -5.5310 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.2200 -9.6430 -6.0750 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.4700 -4.9420 2.5390 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.9520 -3.2280 2.5530 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.6920 -5.5250 3.5550 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.0500 -3.4570 5.0860 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.1560 -4.6490 5.8120 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.6840 -5.1950 4.9720 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.9480 -2.4920 3.7790 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.9350 -3.5430 2.7350 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.0540 -3.6840 4.5050 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 4 5 1 0 0 0 0 4 29 1 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 5 32 1 0 0 0 0 6 7 1 0 0 0 0 6 33 1 0 0 0 0 6 34 1 0 0 0 0 7 8 1 0 0 0 0 7 18 1 0 0 0 0 8 9 1 0 0 0 0 8 35 1 0 0 0 0 8 36 1 0 0 0 0 9 10 2 0 0 0 0 9 11 1 0 0 0 0 11 12 1 0 0 0 0 11 37 1 0 0 0 0 12 13 2 0 0 0 0 12 16 1 0 0 0 0 13 14 1 0 0 0 0 14 15 2 0 0 0 0 14 17 1 0 0 0 0 15 16 1 0 0 0 0 15 38 1 0 0 0 0 17 39 1 0 0 0 0 17 40 1 0 0 0 0 17 41 1 0 0 0 0 18 19 2 0 0 0 0 18 20 1 0 0 0 0 20 21 1 0 0 0 0 20 42 1 0 0 0 0 20 43 1 0 0 0 0 21 22 1 0 0 0 0 21 23 1 0 0 0 0 21 44 1 0 0 0 0 22 45 1 0 0 0 0 22 46 1 0 0 0 0 22 47 1 0 0 0 0 23 48 1 0 0 0 0 23 49 1 0 0 0 0 23 50 1 0 0 0 0 M END