PUBCHEM-ZINC05695583 MOE2007 3D CORINA 3.40 0006 02.08.2006 50 53 0 0 0 0 0 0 0 0999 V2000 -0.0170 1.4250 0.0100 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0020 -0.0040 0.0020 O 0 0 0 0 0 0 0 0 0 0 0 0 0.6060 -0.6080 -1.0560 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1680 0.1610 -2.0650 C 0 0 0 0 0 0 0 0 0 0 0 0 1.7840 -0.4460 -3.1450 C 0 0 0 0 0 0 0 0 0 0 0 0 1.8470 -1.8210 -3.2280 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2850 -2.6090 -2.2200 C 0 0 0 0 0 0 0 0 0 0 0 0 0.6660 -1.9940 -1.1240 C 0 0 0 0 0 0 0 0 0 0 0 0 0.1210 -2.7500 -0.1350 O 0 0 0 0 0 0 0 0 0 0 0 0 1.3490 -4.0790 -2.3060 C 0 0 0 0 0 0 0 0 0 0 0 0 0.8260 -4.8070 -1.3670 N 0 0 0 0 0 0 0 0 0 0 0 0 0.8870 -6.2040 -1.4480 N 0 0 0 0 0 0 0 0 0 0 0 0 0.3450 -6.9600 -0.4740 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.1960 -6.4310 0.4740 O 0 0 0 0 0 0 0 0 0 0 0 0 0.4100 -8.4630 -0.5610 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.2460 -9.0500 0.6100 N 0 3 0 0 0 0 0 0 0 0 0 0 -1.5590 -9.3720 0.6900 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.6290 -9.2740 -0.2060 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.8720 -9.6940 0.1710 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.0890 -10.2180 1.4380 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.0500 -10.3250 2.3380 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.7780 -9.9040 1.9730 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.5580 -9.8740 2.6170 N 0 0 0 0 0 0 0 0 0 0 0 0 -0.3770 -10.1740 3.5210 H 0 0 0 0 0 0 0 0 0 0 0 0 0.3500 -9.3480 1.7380 C 0 0 0 0 0 0 0 0 0 0 0 0 1.7880 -9.1420 2.0210 C 0 0 0 0 0 0 0 0 0 0 0 0 2.2180 -8.9890 3.3390 C 0 0 0 0 0 0 0 0 0 0 0 0 3.5670 -8.7970 3.5880 C 0 0 0 0 0 0 0 0 0 0 0 0 4.4410 -8.7650 2.5110 C 0 0 0 0 0 0 0 0 0 0 0 0 3.9450 -8.9240 1.2290 C 0 0 0 0 0 0 0 0 0 0 0 0 2.6580 -9.1100 1.0200 N 0 0 0 0 0 0 0 0 0 0 0 0 1.0050 1.8020 0.0020 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5440 1.7860 -0.8730 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5280 1.7760 0.9070 H 0 0 0 0 0 0 0 0 0 0 0 0 1.1230 1.2380 -2.0070 H 0 0 0 0 0 0 0 0 0 0 0 0 2.2190 0.1600 -3.9260 H 0 0 0 0 0 0 0 0 0 0 0 0 2.3290 -2.2900 -4.0740 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.8060 -2.9810 -0.2820 H 0 0 0 0 0 0 0 0 0 0 0 0 1.8310 -4.5500 -3.1500 H 0 0 0 0 0 0 0 0 0 0 0 0 1.3200 -6.6270 -2.2060 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0980 -8.7970 -1.4670 H 0 0 0 0 0 0 0 0 0 0 0 0 1.4520 -8.7810 -0.5910 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.4720 -8.8680 -1.1940 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.6960 -9.6160 -0.5230 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.0790 -10.5450 1.7200 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.2250 -10.7340 3.3220 H 0 0 0 0 0 0 0 0 0 0 0 0 1.5100 -9.0180 4.1540 H 0 0 0 0 0 0 0 0 0 0 0 0 3.9300 -8.6750 4.5980 H 0 0 0 0 0 0 0 0 0 0 0 0 5.4990 -8.6180 2.6720 H 0 0 0 0 0 0 0 0 0 0 0 0 4.6230 -8.9000 0.3890 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 32 1 0 0 0 0 1 33 1 0 0 0 0 1 34 1 0 0 0 0 2 3 1 0 0 0 0 3 4 1 0 0 0 0 3 8 2 0 0 0 0 4 5 2 0 0 0 0 4 35 1 0 0 0 0 5 6 1 0 0 0 0 5 36 1 0 0 0 0 6 7 2 0 0 0 0 6 37 1 0 0 0 0 7 8 1 0 0 0 0 7 10 1 0 0 0 0 8 9 1 0 0 0 0 9 38 1 0 0 0 0 10 11 2 0 0 0 0 10 39 1 0 0 0 0 11 12 1 0 0 0 0 12 13 1 0 0 0 0 12 40 1 0 0 0 0 13 14 2 0 0 0 0 13 15 1 0 0 0 0 15 16 1 0 0 0 0 15 41 1 0 0 0 0 15 42 1 0 0 0 0 16 17 1 0 0 0 0 16 25 2 0 0 0 0 17 18 1 0 0 0 0 17 22 2 0 0 0 0 18 19 2 0 0 0 0 18 43 1 0 0 0 0 19 20 1 0 0 0 0 19 44 1 0 0 0 0 20 21 2 0 0 0 0 20 45 1 0 0 0 0 21 22 1 0 0 0 0 21 46 1 0 0 0 0 22 23 1 0 0 0 0 23 24 1 0 0 0 0 23 25 1 0 0 0 0 25 26 1 0 0 0 0 26 27 1 0 0 0 0 26 31 2 0 0 0 0 27 28 2 0 0 0 0 27 47 1 0 0 0 0 28 29 1 0 0 0 0 28 48 1 0 0 0 0 29 30 2 0 0 0 0 29 49 1 0 0 0 0 30 31 1 0 0 0 0 30 50 1 0 0 0 0 M CHG 1 16 1 M END