PUBCHEM-ZINC06596538 MOE2007 3D CORINA 3.40 0006 02.08.2006 51 52 0 0 1 0 0 0 0 0999 V2000 0.1280 1.6790 0.0400 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0400 0.1760 -0.1480 C 0 0 0 0 0 0 0 0 0 0 0 0 0.9820 -0.4370 -1.1250 C 0 0 3 0 0 0 0 0 0 0 0 0 1.9840 -0.1340 -0.7940 H 0 0 0 0 0 0 0 0 0 0 0 0 0.9590 -1.9520 -1.0910 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0090 -2.6860 -0.7770 N 0 0 0 0 0 0 0 0 0 0 0 0 1.6960 -4.0420 -0.8760 C 0 0 0 0 0 0 0 0 0 0 0 0 0.3900 -4.3110 -1.2330 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.4610 -2.8470 -1.4900 S 0 0 0 0 0 0 0 0 0 0 0 0 2.7230 -5.0470 -0.6240 C 0 0 0 0 0 0 0 0 0 0 0 0 2.5160 -6.2550 -0.6500 O 0 0 0 0 0 0 0 0 0 0 0 0 3.9490 -4.4690 -0.3650 N 0 0 0 0 0 0 0 0 0 0 0 0 5.1600 -5.2280 -0.1190 C 0 0 0 0 0 0 0 0 0 0 0 0 6.3810 -4.3950 -0.5080 C 0 0 0 0 0 0 0 0 0 0 0 0 7.7080 -5.1210 -0.2690 C 0 0 0 0 0 0 0 0 0 0 0 0 6.5150 -6.4240 1.6890 C 0 0 0 0 0 0 0 0 0 0 0 0 5.2450 -5.6320 1.3550 C 0 0 0 0 0 0 0 0 0 0 0 0 6.4780 -7.8640 1.1640 C 0 0 0 0 0 0 0 0 0 0 0 0 6.7070 -6.4760 3.2160 C 0 0 0 0 0 0 0 0 0 0 0 0 8.8710 -4.1130 -0.3350 C 0 0 0 0 0 0 0 0 0 0 0 0 7.9790 -6.2270 -1.2960 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1450 1.9230 0.3620 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0850 2.2270 -0.8830 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5650 2.0400 0.8060 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0630 -0.3050 0.8330 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0660 -0.0220 -0.4830 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0860 -5.2720 -1.3700 H 0 0 0 0 0 0 0 0 0 0 0 0 3.9500 -3.4480 -0.3530 H 0 0 0 0 0 0 0 0 0 0 0 0 5.1030 -6.1240 -0.7460 H 0 0 0 0 0 0 0 0 0 0 0 0 6.3040 -4.0960 -1.5620 H 0 0 0 0 0 0 0 0 0 0 0 0 6.3650 -3.4570 0.0660 H 0 0 0 0 0 0 0 0 0 0 0 0 5.2020 -4.7230 1.9710 H 0 0 0 0 0 0 0 0 0 0 0 0 4.3600 -6.2190 1.6340 H 0 0 0 0 0 0 0 0 0 0 0 0 6.1930 -7.9310 0.1140 H 0 0 0 0 0 0 0 0 0 0 0 0 7.4470 -8.3600 1.2850 H 0 0 0 0 0 0 0 0 0 0 0 0 5.7380 -8.4540 1.7170 H 0 0 0 0 0 0 0 0 0 0 0 0 5.8650 -6.9840 3.7000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.6220 -7.0160 3.4850 H 0 0 0 0 0 0 0 0 0 0 0 0 6.7760 -5.4710 3.6490 H 0 0 0 0 0 0 0 0 0 0 0 0 8.7530 -3.3120 0.4040 H 0 0 0 0 0 0 0 0 0 0 0 0 9.8340 -4.6020 -0.1430 H 0 0 0 0 0 0 0 0 0 0 0 0 8.9260 -3.6420 -1.3230 H 0 0 0 0 0 0 0 0 0 0 0 0 8.1770 -5.7930 -2.2830 H 0 0 0 0 0 0 0 0 0 0 0 0 8.8550 -6.8250 -1.0210 H 0 0 0 0 0 0 0 0 0 0 0 0 7.1350 -6.9050 -1.4290 H 0 0 0 0 0 0 0 0 0 0 0 0 7.7250 -5.6960 1.1340 N 0 3 0 0 0 0 0 0 0 0 0 0 8.5520 -6.3040 1.2340 H 0 0 0 0 0 0 0 0 0 0 0 0 7.9190 -4.9120 1.7750 H 0 0 0 0 0 0 0 0 0 0 0 0 0.8220 0.0580 -2.4970 N 0 0 0 0 0 0 0 0 0 0 0 0 0.9230 1.0720 -2.5130 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.1260 -0.1350 -2.8190 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 22 1 0 0 0 0 1 23 1 0 0 0 0 1 24 1 0 0 0 0 2 3 1 0 0 0 0 2 25 1 0 0 0 0 2 26 1 0 0 0 0 3 4 1 0 0 0 0 3 5 1 0 0 0 0 3 49 1 0 0 0 0 5 6 2 0 0 0 0 5 9 1 0 0 0 0 6 7 1 0 0 0 0 7 8 2 0 0 0 0 7 10 1 0 0 0 0 8 9 1 0 0 0 0 8 27 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 28 1 0 0 0 0 13 14 1 0 0 0 0 13 17 1 0 0 0 0 13 29 1 0 0 0 0 14 15 1 0 0 0 0 14 30 1 0 0 0 0 14 31 1 0 0 0 0 15 20 1 0 0 0 0 15 21 1 0 0 0 0 15 46 1 0 0 0 0 16 17 1 0 0 0 0 16 18 1 0 0 0 0 16 19 1 0 0 0 0 16 46 1 0 0 0 0 17 32 1 0 0 0 0 17 33 1 0 0 0 0 18 34 1 0 0 0 0 18 35 1 0 0 0 0 18 36 1 0 0 0 0 19 37 1 0 0 0 0 19 38 1 0 0 0 0 19 39 1 0 0 0 0 20 40 1 0 0 0 0 20 41 1 0 0 0 0 20 42 1 0 0 0 0 21 43 1 0 0 0 0 21 44 1 0 0 0 0 21 45 1 0 0 0 0 46 47 1 0 0 0 0 46 48 1 0 0 0 0 49 50 1 0 0 0 0 49 51 1 0 0 0 0 M CHG 1 46 1 M END