PUBCHEM-ZINC06522559 MOE2007 3D CORINA 3.40 0006 02.08.2006 50 51 0 0 1 0 0 0 0 0999 V2000 1.2080 1.6390 0.5030 C 0 0 0 0 0 0 0 0 0 0 0 0 0.8670 0.1810 0.4030 C 0 0 0 0 0 0 0 0 0 0 0 0 0.4970 -0.5420 1.5400 C 0 0 0 0 0 0 0 0 0 0 0 0 0.2100 -1.9080 1.4480 C 0 0 0 0 0 0 0 0 0 0 0 0 0.2930 -2.5910 0.2250 C 0 0 0 0 0 0 0 0 0 0 0 0 0.6830 -1.8600 -0.9040 C 0 0 0 0 0 0 0 0 0 0 0 0 0.9690 -0.4920 -0.8180 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0160 -3.9630 0.2040 N 0 0 0 0 0 0 0 0 0 0 0 0 0.2490 -4.6990 -0.9340 N 0 0 0 0 0 0 0 0 0 0 0 0 -0.7600 -5.5200 -1.3890 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.8480 -5.6980 -0.8310 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.4180 -6.2880 -2.6670 C 0 0 3 0 0 0 0 0 0 0 0 0 0.3020 -5.7290 -3.2740 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.7250 -6.5400 -3.4580 C 0 0 3 0 0 0 0 0 0 0 0 0 -2.2660 -5.5990 -3.5990 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.4590 -7.2400 -4.8000 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.7030 -7.5470 -5.6650 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.2650 -8.2780 -6.9490 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.4460 -8.5800 -7.8670 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.2280 -7.3160 -8.2070 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.6770 -6.5860 -6.9470 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.5040 -6.2830 -6.0150 C 0 0 0 0 0 0 0 0 0 0 0 0 0.1410 -7.5550 -2.3150 O 0 0 0 0 0 0 0 0 0 0 0 0 2.2740 1.7600 0.7190 H 0 0 0 0 0 0 0 0 0 0 0 0 0.9740 2.1600 -0.4310 H 0 0 0 0 0 0 0 0 0 0 0 0 0.6290 2.1220 1.2980 H 0 0 0 0 0 0 0 0 0 0 0 0 0.4290 -0.0490 2.5070 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0750 -2.4390 2.3530 H 0 0 0 0 0 0 0 0 0 0 0 0 0.7600 -2.3340 -1.8780 H 0 0 0 0 0 0 0 0 0 0 0 0 1.2720 0.0460 -1.7140 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.3740 -4.4280 1.0190 H 0 0 0 0 0 0 0 0 0 0 0 0 1.1640 -4.5970 -1.3640 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.7730 -6.6120 -5.3830 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9270 -8.1840 -4.6190 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.3600 -8.2280 -5.1090 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.5330 -7.6680 -7.4930 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.7640 -9.2180 -6.6900 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.0840 -9.0490 -8.7900 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.1120 -9.3040 -7.3810 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.6010 -6.6500 -8.8120 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.1010 -7.5750 -8.8160 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.1790 -5.6520 -7.2220 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.4150 -7.1990 -6.4140 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.9020 -5.8180 -5.1070 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.8460 -5.5460 -6.4910 H 0 0 0 0 0 0 0 0 0 0 0 0 1.0220 -7.4090 -1.9230 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.6040 -7.4130 -2.6110 N 0 3 0 0 0 0 0 0 0 0 0 0 -3.5230 -7.6200 -3.0150 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.7510 -6.9270 -1.6980 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.1050 -8.2870 -2.3890 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 24 1 0 0 0 0 1 25 1 0 0 0 0 1 26 1 0 0 0 0 2 3 1 0 0 0 0 2 7 2 0 0 0 0 3 4 2 0 0 0 0 3 27 1 0 0 0 0 4 5 1 0 0 0 0 4 28 1 0 0 0 0 5 6 2 0 0 0 0 5 8 1 0 0 0 0 6 7 1 0 0 0 0 6 29 1 0 0 0 0 7 30 1 0 0 0 0 8 9 1 0 0 0 0 8 31 1 0 0 0 0 9 10 1 0 0 0 0 9 32 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 14 1 0 0 0 0 12 23 1 0 0 0 0 14 15 1 0 0 0 0 14 16 1 0 0 0 0 14 47 1 0 0 0 0 16 17 1 0 0 0 0 16 33 1 0 0 0 0 16 34 1 0 0 0 0 17 18 1 0 0 0 0 17 22 1 0 0 0 0 17 35 1 0 0 0 0 18 19 1 0 0 0 0 18 36 1 0 0 0 0 18 37 1 0 0 0 0 19 20 1 0 0 0 0 19 38 1 0 0 0 0 19 39 1 0 0 0 0 20 21 1 0 0 0 0 20 40 1 0 0 0 0 20 41 1 0 0 0 0 21 22 1 0 0 0 0 21 42 1 0 0 0 0 21 43 1 0 0 0 0 22 44 1 0 0 0 0 22 45 1 0 0 0 0 23 46 1 0 0 0 0 47 48 1 0 0 0 0 47 49 1 0 0 0 0 47 50 1 0 0 0 0 M CHG 1 47 1 M END