PUBCHEM-ZINC00469977 MOE2007 3D CORINA 3.40 0006 02.08.2006 43 44 0 0 0 0 0 0 0 0999 V2000 -0.0180 1.4480 0.0100 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0020 -0.0040 0.0020 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.1860 -0.6300 0.0100 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.2080 0.0140 0.0230 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.2440 -2.1360 0.0020 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.6090 -2.5590 0.0130 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.8390 -3.8990 0.0080 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.1400 -4.3800 0.0180 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.3710 -5.7420 0.0130 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.3070 -6.6250 -0.0020 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.0100 -6.1480 -0.0110 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.7730 -4.7870 -0.0120 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.6060 -8.3620 -0.0080 S 0 0 0 0 0 0 0 0 0 0 0 0 -2.4370 -8.9720 0.5220 O 0 0 0 0 0 0 0 0 0 0 0 0 -4.9000 -8.5480 0.5480 O 0 0 0 0 0 0 0 0 0 0 0 0 -3.7040 -8.8360 -1.5920 N 0 0 0 0 0 0 0 0 0 0 0 0 -2.5290 -8.7350 -2.4610 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.7590 -9.5630 -3.7270 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.5500 -9.4590 -4.6210 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.5160 -10.3670 -4.4940 C 0 0 0 0 0 0 0 0 0 0 0 0 0.5930 -10.2720 -5.3140 C 0 0 0 0 0 0 0 0 0 0 0 0 0.6670 -9.2680 -6.2620 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.3670 -8.3610 -6.3900 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.4780 -8.4580 -5.5730 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0050 1.8250 0.0020 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5450 1.8090 -0.8730 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5280 1.7990 0.9070 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.7530 -2.5140 -0.8940 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.7360 -2.5230 0.8860 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.9710 -3.6910 0.0300 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.3840 -6.1170 0.0210 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.1800 -6.8400 -0.0220 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.7600 -4.4140 -0.0250 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.5390 -9.1810 -1.9440 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.3660 -7.6920 -2.7330 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.6530 -9.1140 -1.9340 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.9210 -10.6060 -3.4550 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.6340 -9.1840 -4.2550 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5740 -11.1510 -3.7530 H 0 0 0 0 0 0 0 0 0 0 0 0 1.4010 -10.9810 -5.2140 H 0 0 0 0 0 0 0 0 0 0 0 0 1.5340 -9.1940 -6.9020 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.3090 -7.5760 -7.1300 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.2880 -7.7510 -5.6750 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 25 1 0 0 0 0 1 26 1 0 0 0 0 1 27 1 0 0 0 0 2 3 1 0 0 0 0 3 4 2 0 0 0 0 3 5 1 0 0 0 0 5 6 1 0 0 0 0 5 28 1 0 0 0 0 5 29 1 0 0 0 0 6 7 1 0 0 0 0 7 8 1 0 0 0 0 7 12 2 0 0 0 0 8 9 2 0 0 0 0 8 30 1 0 0 0 0 9 10 1 0 0 0 0 9 31 1 0 0 0 0 10 11 2 0 0 0 0 10 13 1 0 0 0 0 11 12 1 0 0 0 0 11 32 1 0 0 0 0 12 33 1 0 0 0 0 13 14 2 0 0 0 0 13 15 2 0 0 0 0 13 16 1 0 0 0 0 16 17 1 0 0 0 0 16 34 1 0 0 0 0 17 18 1 0 0 0 0 17 35 1 0 0 0 0 17 36 1 0 0 0 0 18 19 1 0 0 0 0 18 37 1 0 0 0 0 18 38 1 0 0 0 0 19 20 1 0 0 0 0 19 24 2 0 0 0 0 20 21 2 0 0 0 0 20 39 1 0 0 0 0 21 22 1 0 0 0 0 21 40 1 0 0 0 0 22 23 2 0 0 0 0 22 41 1 0 0 0 0 23 24 1 0 0 0 0 23 42 1 0 0 0 0 24 43 1 0 0 0 0 M END