PUBCHEM-ZINC06754987 MOE2007 3D CORINA 3.40 0006 02.08.2006 42 43 0 0 1 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 0.7420 -0.5430 1.2410 C 0 0 3 0 0 0 0 0 0 0 0 0 1.0600 0.2990 1.8550 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.5210 -1.0400 1.9880 C 0 0 3 0 0 0 0 0 0 0 0 0 -1.7120 -0.1520 2.5900 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.6970 -0.6750 0.1920 S 0 0 0 0 0 0 0 0 0 0 0 0 -2.4340 -2.1950 2.4080 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.1610 -3.3630 1.5680 N 0 0 0 0 0 0 0 0 0 0 0 0 -2.8510 -4.5060 1.7580 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.6970 -4.5660 2.6250 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.5700 -5.7080 0.8940 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.4220 -6.7860 1.2860 O 0 0 0 0 0 0 0 0 0 0 0 0 -3.2960 -7.9530 0.6020 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.0920 -9.0410 0.9300 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.9610 -10.2260 0.2320 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.0380 -10.3290 -0.7920 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.2440 -9.2460 -1.1210 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.3740 -8.0570 -0.4300 C 0 0 0 0 0 0 0 0 0 0 0 0 1.9640 -1.2990 0.7860 C 0 0 0 0 0 0 0 0 0 0 0 0 1.9420 -2.5060 0.7300 O 0 0 0 0 0 0 0 0 0 0 0 0 0.6500 -0.5250 -1.2820 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 -2.2450 -2.4460 3.4520 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.4750 -1.8960 2.2890 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.4840 -3.3150 0.8750 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.7590 -5.4570 -0.1500 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.5280 -6.0060 1.0130 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.8120 -8.9610 1.7300 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.5800 -11.0730 0.4880 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.9380 -11.2560 -1.3360 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.5230 -9.3290 -1.9210 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.7570 -7.2100 -0.6910 H 0 0 0 0 0 0 0 0 0 0 0 0 1.6780 -0.1680 -1.3410 H 0 0 0 0 0 0 0 0 0 0 0 0 0.6450 -1.6150 -1.2750 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0900 -0.1640 -2.1440 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0870 -1.4370 2.0560 N 0 0 0 0 0 0 0 0 0 0 0 0 0.0360 -2.3990 1.7770 H 0 0 0 0 0 0 0 0 0 0 0 0 3.0770 -0.6320 0.4430 O 0 0 0 0 0 0 0 0 0 0 0 0 3.8350 -1.1600 0.1580 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 23 1 0 0 0 0 1 24 1 0 0 0 0 1 25 1 0 0 0 0 2 3 1 0 0 0 0 2 7 1 0 0 0 0 2 22 1 0 0 0 0 3 4 1 0 0 0 0 3 20 1 0 0 0 0 3 39 1 0 0 0 0 5 6 1 0 0 0 0 5 7 1 0 0 0 0 5 8 1 0 0 0 0 5 39 1 0 0 0 0 8 9 1 0 0 0 0 8 26 1 0 0 0 0 8 27 1 0 0 0 0 9 10 1 0 0 0 0 9 28 1 0 0 0 0 10 11 2 0 0 0 0 10 12 1 0 0 0 0 12 13 1 0 0 0 0 12 29 1 0 0 0 0 12 30 1 0 0 0 0 13 14 1 0 0 0 0 14 15 1 0 0 0 0 14 19 2 0 0 0 0 15 16 2 0 0 0 0 15 31 1 0 0 0 0 16 17 1 0 0 0 0 16 32 1 0 0 0 0 17 18 2 0 0 0 0 17 33 1 0 0 0 0 18 19 1 0 0 0 0 18 34 1 0 0 0 0 19 35 1 0 0 0 0 20 21 2 0 0 0 0 20 41 1 0 0 0 0 22 36 1 0 0 0 0 22 37 1 0 0 0 0 22 38 1 0 0 0 0 39 40 1 0 0 0 0 41 42 1 0 0 0 0 M END