PUBCHEM-ZINC04773678 MOE2007 3D CORINA 3.40 0006 02.08.2006 38 40 0 0 1 0 0 0 0 0999 V2000 -0.0220 1.8100 0.0120 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0020 -0.0040 0.0020 S 0 3 0 0 0 0 0 0 0 0 0 0 0.5370 -0.4140 1.6860 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.7600 -0.4360 0.0160 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.9120 -1.9590 0.0100 C 0 0 3 0 0 0 0 0 0 0 0 0 -1.3640 -2.3900 -0.8280 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.4040 -2.3500 -0.0650 C 0 0 3 0 0 0 0 0 0 0 0 0 -3.6840 -2.5940 -1.0900 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.5100 -3.6000 0.8370 C 0 0 3 0 0 0 0 0 0 0 0 0 -3.8430 -4.4610 0.2590 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.0700 -3.8150 1.3510 C 0 0 3 0 0 0 0 0 0 0 0 0 -1.5450 -4.5330 0.7200 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.4440 -2.5160 1.2570 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.0870 -4.2770 2.7410 N 0 0 0 0 0 0 0 0 0 0 0 0 -1.8450 -5.5480 3.1830 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.9750 -5.5050 4.5820 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.7720 -6.7000 5.3020 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.4710 -7.8030 4.6260 N 0 0 0 0 0 0 0 0 0 0 0 0 -1.3610 -7.7920 3.3100 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.5400 -6.7020 2.5950 N 0 0 0 0 0 0 0 0 0 0 0 0 -1.8850 -6.7230 6.6790 N 0 0 0 0 0 0 0 0 0 0 0 0 -2.2820 -4.2430 4.9280 N 0 0 0 0 0 0 0 0 0 0 0 0 -2.3500 -3.5000 3.8790 N 0 0 0 0 0 0 0 0 0 0 0 0 -4.4020 -3.3560 1.9270 O 0 0 0 0 0 0 0 0 0 0 0 0 -4.2240 -1.2940 0.4380 O 0 0 0 0 0 0 0 0 0 0 0 0 1.0000 2.1870 0.0040 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5500 2.1710 -0.8710 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5330 2.1610 0.9090 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.1780 -0.0090 2.4030 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5880 -1.4970 1.7980 H 0 0 0 0 0 0 0 0 0 0 0 0 1.5210 0.0170 1.8700 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.2260 -0.0280 0.9130 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.2430 -0.0190 -0.8670 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.1140 -8.7120 2.8010 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.1050 -5.9110 7.1610 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.7440 -7.5520 7.1630 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.5060 -4.1080 2.5260 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.1720 -1.4860 0.4150 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 26 1 0 0 0 0 1 27 1 0 0 0 0 1 28 1 0 0 0 0 2 3 1 0 0 0 0 2 4 1 0 0 0 0 3 29 1 0 0 0 0 3 30 1 0 0 0 0 3 31 1 0 0 0 0 4 5 1 0 0 0 0 4 32 1 0 0 0 0 4 33 1 0 0 0 0 5 6 1 0 0 0 0 5 7 1 0 0 0 0 5 13 1 0 0 0 0 7 8 1 0 0 0 0 7 9 1 0 0 0 0 7 25 1 0 0 0 0 9 10 1 0 0 0 0 9 11 1 0 0 0 0 9 24 1 0 0 0 0 11 12 1 0 0 0 0 11 13 1 0 0 0 0 11 14 1 0 0 0 0 14 15 1 0 0 0 0 14 23 1 0 0 0 0 15 16 1 0 0 0 0 15 20 2 0 0 0 0 16 17 2 0 0 0 0 16 22 1 0 0 0 0 17 18 1 0 0 0 0 17 21 1 0 0 0 0 18 19 2 0 0 0 0 19 20 1 0 0 0 0 19 34 1 0 0 0 0 21 35 1 0 0 0 0 21 36 1 0 0 0 0 22 23 2 0 0 0 0 24 37 1 0 0 0 0 25 38 1 0 0 0 0 M CHG 1 2 1 M END