PUBCHEM-ZINC05846160 MOE2007 3D CORINA 3.40 0006 02.08.2006 45 48 0 0 1 0 0 0 0 0999 V2000 -0.6180 0.7180 1.3680 C 0 0 0 0 0 0 0 0 0 0 0 0 0.6610 -0.0650 1.1130 C 0 0 0 0 0 0 0 0 0 0 0 0 0.6320 -0.8290 -0.2100 C 0 0 3 0 0 0 0 0 0 0 0 0 0.4590 -0.1250 -1.0360 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.4180 -1.9350 -0.2790 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0740 -2.8070 -1.4330 C 0 0 0 0 0 0 0 0 0 0 0 0 1.5290 -2.6820 -1.3730 N 0 0 0 0 0 0 0 0 0 0 0 0 1.9360 -1.5950 -0.4810 C 0 0 0 0 0 0 0 0 0 0 0 0 2.4110 -3.4920 -2.0730 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7990 -3.4690 -1.8400 C 0 0 0 0 0 0 0 0 0 0 0 0 4.7010 -4.2730 -2.5400 C 0 0 0 0 0 0 0 0 0 0 0 0 4.2380 -5.1570 -3.5140 C 0 0 0 0 0 0 0 0 0 0 0 0 2.8670 -5.2570 -3.7950 C 0 0 0 0 0 0 0 0 0 0 0 0 1.9880 -4.4050 -3.0760 C 0 0 0 0 0 0 0 0 0 0 0 0 0.6810 -4.4350 -3.3900 F 0 0 0 0 0 0 0 0 0 0 0 0 2.4380 -6.1920 -4.7850 N 0 0 0 0 0 0 0 0 0 0 0 0 3.3820 -6.8690 -5.5370 C 0 0 0 0 0 0 0 0 0 0 0 0 4.7080 -6.8280 -5.3610 C 0 0 0 0 0 0 0 0 0 0 0 0 5.2160 -6.0000 -4.2520 C 0 0 0 0 0 0 0 0 0 0 0 0 6.3900 -6.0010 -3.9020 O 0 0 0 0 0 0 0 0 0 0 0 0 5.6200 -7.6150 -6.3010 C 0 0 0 0 0 0 0 0 0 0 0 0 5.2900 -8.8240 -6.4890 O 0 5 0 0 0 0 0 0 0 0 0 0 1.0120 -6.4540 -5.0580 C 0 0 0 0 0 0 0 0 0 0 0 0 0.1230 -7.1220 -4.0350 C 0 0 0 0 0 0 0 0 0 0 0 0 0.4620 -7.8410 -5.3010 C 0 0 0 0 0 0 0 0 0 0 0 0 4.3220 -2.6580 -0.9060 F 0 0 0 0 0 0 0 0 0 0 0 0 -0.8180 1.4190 0.5520 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.4800 0.0520 1.4700 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5280 1.2930 2.2950 H 0 0 0 0 0 0 0 0 0 0 0 0 1.5070 0.6330 1.1060 H 0 0 0 0 0 0 0 0 0 0 0 0 0.8290 -0.7560 1.9480 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.4300 -2.5170 0.6510 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.4290 -1.5570 -0.4580 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.2670 -3.8380 -1.2900 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.3000 -2.4230 -2.3880 H 0 0 0 0 0 0 0 0 0 0 0 0 2.6670 -0.9260 -0.9480 H 0 0 0 0 0 0 0 0 0 0 0 0 2.3550 -2.0080 0.4450 H 0 0 0 0 0 0 0 0 0 0 0 0 5.7610 -4.1990 -2.3120 H 0 0 0 0 0 0 0 0 0 0 0 0 2.9640 -7.4760 -6.3370 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5690 -5.6550 -5.6490 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5780 -7.4750 -3.1170 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.8810 -6.7350 -3.9160 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.3140 -7.9500 -6.0490 H 0 0 0 0 0 0 0 0 0 0 0 0 1.1260 -8.6940 -5.2240 H 0 0 0 0 0 0 0 0 0 0 0 0 6.5590 -6.9580 -6.8330 O 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 27 1 0 0 0 0 1 28 1 0 0 0 0 1 29 1 0 0 0 0 2 3 1 0 0 0 0 2 30 1 0 0 0 0 2 31 1 0 0 0 0 3 4 1 0 0 0 0 3 5 1 0 0 0 0 3 8 1 0 0 0 0 5 6 1 0 0 0 0 5 32 1 0 0 0 0 5 33 1 0 0 0 0 6 7 1 0 0 0 0 6 34 1 0 0 0 0 6 35 1 0 0 0 0 7 8 1 0 0 0 0 7 9 1 0 0 0 0 8 36 1 0 0 0 0 8 37 1 0 0 0 0 9 10 1 0 0 0 0 9 14 2 0 0 0 0 10 11 2 0 0 0 0 10 26 1 0 0 0 0 11 12 1 0 0 0 0 11 38 1 0 0 0 0 12 13 2 0 0 0 0 12 19 1 0 0 0 0 13 14 1 0 0 0 0 13 16 1 0 0 0 0 14 15 1 0 0 0 0 16 17 1 0 0 0 0 16 23 1 0 0 0 0 17 18 2 0 0 0 0 17 39 1 0 0 0 0 18 19 1 0 0 0 0 18 21 1 0 0 0 0 19 20 2 0 0 0 0 21 22 1 0 0 0 0 21 45 2 0 0 0 0 23 24 1 0 0 0 0 23 25 1 0 0 0 0 23 40 1 0 0 0 0 24 25 1 0 0 0 0 24 41 1 0 0 0 0 24 42 1 0 0 0 0 25 43 1 0 0 0 0 25 44 1 0 0 0 0 M CHG 1 22 -1 M END