PUBCHEM-ZINC06411846 MOE2007 3D CORINA 3.40 0006 02.08.2006 46 45 0 0 1 0 0 0 0 0999 V2000 -1.4780 -0.0830 3.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.9030 -1.0170 1.8750 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.0070 -2.4970 2.3050 C 0 0 3 0 0 0 0 0 0 0 0 0 -1.0430 -2.7770 2.7510 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.0770 -2.7020 3.3860 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.2330 -3.4020 1.0730 C 0 0 3 0 0 0 0 0 0 0 0 0 -1.4310 -3.2110 0.3470 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.1130 -4.9390 1.4030 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.0470 -5.6590 0.8900 O 0 0 0 0 0 0 0 0 0 0 0 0 -3.5130 -3.1340 0.3950 N 0 0 0 0 0 0 0 0 0 0 0 0 -3.6520 -3.4480 -0.9480 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.7810 -3.2960 -1.7980 O 0 0 0 0 0 0 0 0 0 0 0 0 -4.9130 -4.2880 -1.1940 C 0 0 3 0 0 0 0 0 0 0 0 0 -5.7300 -3.9330 -0.5560 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.3150 -4.3020 -2.6690 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.5480 -5.1630 -2.9460 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.8830 -5.1990 -4.4330 C 0 0 0 0 0 0 0 0 0 0 0 0 -8.4700 -6.4370 -5.9080 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.9480 -5.9100 -7.0370 N 0 3 0 0 0 0 0 0 0 0 0 0 -8.3090 -6.1460 -7.9530 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.1720 -5.2610 -6.9940 H 0 0 0 0 0 0 0 0 0 0 0 0 -9.4970 -7.3080 -6.0190 N 0 0 0 0 0 0 0 0 0 0 0 0 -9.9220 -7.7390 -5.2070 H 0 0 0 0 0 0 0 0 0 0 0 0 -9.8760 -7.5630 -6.9240 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.3170 0.9260 2.6080 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.2440 -0.0160 3.7770 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5430 -0.4200 3.4600 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.8610 -0.6690 1.4700 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.1680 -0.9300 1.0660 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.2110 -3.7620 3.6210 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.7890 -2.2050 4.3180 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.0460 -2.2960 3.0800 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.3020 -2.8320 0.9540 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.5110 -3.2720 -2.9960 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.4790 -4.6620 -3.2820 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.3840 -6.1910 -2.6050 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.4080 -4.7800 -2.3830 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.1730 -4.2010 -4.7790 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.0170 -5.5570 -5.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.1320 -5.2920 2.1060 O 0 5 0 0 0 0 0 0 0 0 0 0 -8.0010 -6.1180 -4.6770 N 0 0 0 0 0 0 0 0 0 0 0 0 -8.4660 -6.5550 -3.8890 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.6150 -5.6950 -0.7590 N 0 3 0 0 0 0 0 0 0 0 0 0 -4.0370 -6.2160 -1.4250 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.4110 -6.2520 -0.4460 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.9350 -5.6800 0.1040 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 2 28 1 0 0 0 0 2 29 1 0 0 0 0 3 4 1 0 0 0 0 3 5 1 0 0 0 0 3 6 1 0 0 0 0 5 30 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 8 1 0 0 0 0 6 10 1 0 0 0 0 8 9 2 0 0 0 0 8 40 1 0 0 0 0 10 11 1 0 0 0 0 10 33 1 0 0 0 0 11 12 2 0 0 0 0 11 13 1 0 0 0 0 13 14 1 0 0 0 0 13 15 1 0 0 0 0 13 43 1 0 0 0 0 15 16 1 0 0 0 0 15 34 1 0 0 0 0 15 35 1 0 0 0 0 16 17 1 0 0 0 0 16 36 1 0 0 0 0 16 37 1 0 0 0 0 17 38 1 0 0 0 0 17 39 1 0 0 0 0 17 41 1 0 0 0 0 18 19 2 0 0 0 0 18 22 1 0 0 0 0 18 41 1 0 0 0 0 19 20 1 0 0 0 0 19 21 1 0 0 0 0 22 23 1 0 0 0 0 22 24 1 0 0 0 0 41 42 1 0 0 0 0 43 44 1 0 0 0 0 43 45 1 0 0 0 0 43 46 1 0 0 0 0 M CHG 1 19 1 M CHG 1 40 -1 M CHG 1 43 1 M END