PUBCHEM-ZINC06974225 MOE2007 3D CORINA 3.40 0006 02.08.2006 55 57 0 0 0 0 0 0 0 0999 V2000 -0.4410 1.4350 0.0300 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.1940 -0.0080 0.0120 N 0 0 0 0 0 0 0 0 0 0 0 0 -0.0770 -0.6990 1.1980 C 0 0 0 0 0 0 0 0 0 0 0 0 0.1530 -2.0460 1.1670 C 0 0 0 0 0 0 0 0 0 0 0 0 0.2670 -2.6970 -0.0780 C 0 0 0 0 0 0 0 0 0 0 0 0 0.4720 -3.8970 -0.1280 O 0 0 0 0 0 0 0 0 0 0 0 0 0.1460 -1.9790 -1.2130 N 0 0 0 0 0 0 0 0 0 0 0 0 -0.0870 -0.6550 -1.1640 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.1980 -0.0300 -2.2010 O 0 0 0 0 0 0 0 0 0 0 0 0 0.2620 -2.6480 -2.5110 C 0 0 0 0 0 0 0 0 0 0 0 0 0.2290 -2.4970 2.4920 N 0 0 0 0 0 0 0 0 0 0 0 0 0.0420 -1.4110 3.3070 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0430 -1.4230 4.6140 N 0 3 0 0 0 0 0 0 0 0 0 0 0.6560 -0.3240 5.3730 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.3730 0.2200 6.3700 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.8940 -0.9280 7.2370 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.5840 -1.9670 6.3500 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.5750 -2.5330 5.3530 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.1460 -0.3070 2.5110 N 0 0 0 0 0 0 0 0 0 0 0 0 -0.3010 0.5980 2.8240 H 0 0 0 0 0 0 0 0 0 0 0 0 0.4640 -3.8760 2.9260 C 0 0 0 0 0 0 0 0 0 0 0 0 1.9690 -4.1560 2.9450 C 0 0 0 0 0 0 0 0 0 0 0 0 2.2040 -5.5350 3.3790 N 0 0 0 0 0 0 0 0 0 0 0 0 3.4840 -6.0150 3.4730 C 0 0 0 0 0 0 0 0 0 0 0 0 3.6910 -7.2320 3.8560 N 0 3 0 0 0 0 0 0 0 0 0 0 2.5580 -8.0990 4.1890 C 0 0 0 0 0 0 0 0 0 0 0 0 5.0600 -7.7450 3.9570 C 0 0 0 0 0 0 0 0 0 0 0 0 0.5110 1.9670 0.0360 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0090 1.7180 -0.8560 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0080 1.6960 0.9240 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.7220 -2.9870 -2.8350 H 0 0 0 0 0 0 0 0 0 0 0 0 0.6650 -1.9500 -3.2450 H 0 0 0 0 0 0 0 0 0 0 0 0 0.9300 -3.5040 -2.4200 H 0 0 0 0 0 0 0 0 0 0 0 0 1.5270 -0.6940 5.9120 H 0 0 0 0 0 0 0 0 0 0 0 0 0.9560 0.4690 4.6880 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0980 0.9700 7.0050 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.2030 0.6710 5.8260 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0600 -1.3950 7.7610 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.6070 -0.5400 7.9640 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.9750 -2.7730 6.9700 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.4030 -1.4950 5.8060 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0850 -3.1970 4.6550 H 0 0 0 0 0 0 0 0 0 0 0 0 0.1950 -3.0870 5.8900 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0560 -4.0170 3.9270 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0240 -4.5630 2.2340 H 0 0 0 0 0 0 0 0 0 0 0 0 2.3770 -4.0150 1.9440 H 0 0 0 0 0 0 0 0 0 0 0 0 2.4570 -3.4690 3.6360 H 0 0 0 0 0 0 0 0 0 0 0 0 1.4530 -6.1090 3.5990 H 0 0 0 0 0 0 0 0 0 0 0 0 4.3190 -5.3760 3.2270 H 0 0 0 0 0 0 0 0 0 0 0 0 2.2310 -8.6290 3.2950 H 0 0 0 0 0 0 0 0 0 0 0 0 2.8630 -8.8200 4.9480 H 0 0 0 0 0 0 0 0 0 0 0 0 1.7380 -7.4920 4.5730 H 0 0 0 0 0 0 0 0 0 0 0 0 5.7630 -6.9630 3.6710 H 0 0 0 0 0 0 0 0 0 0 0 0 5.2580 -8.0540 4.9830 H 0 0 0 0 0 0 0 0 0 0 0 0 5.1780 -8.6000 3.2910 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 28 1 0 0 0 0 1 29 1 0 0 0 0 1 30 1 0 0 0 0 2 3 1 0 0 0 0 2 8 1 0 0 0 0 3 4 2 0 0 0 0 3 19 1 0 0 0 0 4 5 1 0 0 0 0 4 11 1 0 0 0 0 5 6 2 0 0 0 0 5 7 1 0 0 0 0 7 8 1 0 0 0 0 7 10 1 0 0 0 0 8 9 2 0 0 0 0 10 31 1 0 0 0 0 10 32 1 0 0 0 0 10 33 1 0 0 0 0 11 12 1 0 0 0 0 11 21 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 18 1 0 0 0 0 14 15 1 0 0 0 0 14 34 1 0 0 0 0 14 35 1 0 0 0 0 15 16 1 0 0 0 0 15 36 1 0 0 0 0 15 37 1 0 0 0 0 16 17 1 0 0 0 0 16 38 1 0 0 0 0 16 39 1 0 0 0 0 17 18 1 0 0 0 0 17 40 1 0 0 0 0 17 41 1 0 0 0 0 18 42 1 0 0 0 0 18 43 1 0 0 0 0 19 20 1 0 0 0 0 21 22 1 0 0 0 0 21 44 1 0 0 0 0 21 45 1 0 0 0 0 22 23 1 0 0 0 0 22 46 1 0 0 0 0 22 47 1 0 0 0 0 23 24 1 0 0 0 0 23 48 1 0 0 0 0 24 25 2 0 0 0 0 24 49 1 0 0 0 0 25 26 1 0 0 0 0 25 27 1 0 0 0 0 26 50 1 0 0 0 0 26 51 1 0 0 0 0 26 52 1 0 0 0 0 27 53 1 0 0 0 0 27 54 1 0 0 0 0 27 55 1 0 0 0 0 M CHG 1 13 1 M CHG 1 25 1 M END