PUBCHEM-ZINC06167868 MOE2007 3D CORINA 3.40 0006 02.08.2006 62 65 0 0 0 0 0 0 0 0999 V2000 -0.0180 1.5030 0.0100 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0020 -0.0040 0.0020 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0230 -0.7010 1.1960 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0420 -2.0820 1.1910 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0400 -2.7700 -0.0130 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0190 -2.0690 -1.2100 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0060 -0.6880 -1.2000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0580 -4.1290 -0.0210 O 0 0 0 0 0 0 0 0 0 0 0 0 0.0550 -4.7710 -1.2970 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0780 -6.2890 -1.1050 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0750 -6.9470 -2.4140 N 0 3 0 0 0 0 0 0 0 0 0 0 1.1820 -7.2830 -3.1240 C 0 0 0 0 0 0 0 0 0 0 0 0 2.5540 -7.1420 -2.8940 C 0 0 0 0 0 0 0 0 0 0 0 0 3.4490 -7.5930 -3.8210 C 0 0 0 0 0 0 0 0 0 0 0 0 3.0120 -8.1920 -4.9950 C 0 0 0 0 0 0 0 0 0 0 0 0 1.6640 -8.3410 -5.2430 C 0 0 0 0 0 0 0 0 0 0 0 0 0.7400 -7.8890 -4.3110 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.6400 -7.8840 -4.2500 N 0 0 0 0 0 0 0 0 0 0 0 0 -1.2460 -8.2340 -4.9220 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9900 -7.3030 -3.0710 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.4060 -7.0980 -2.5970 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.3140 -7.6110 -3.5740 O 0 0 0 0 0 0 0 0 0 0 0 0 -4.6410 -7.5040 -3.2990 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.5790 -7.9820 -4.2030 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.9270 -7.8720 -3.9210 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.3420 -7.2870 -2.7390 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.4090 -6.8100 -1.8360 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.0600 -6.9230 -2.1110 C 0 0 0 0 0 0 0 0 0 0 0 0 -8.8130 -7.1680 -2.4340 C 0 0 0 0 0 0 0 0 0 0 0 0 -9.4400 -8.5640 -2.3970 C 0 0 0 0 0 0 0 0 0 0 0 0 -8.9990 -6.4890 -1.0760 C 0 0 0 0 0 0 0 0 0 0 0 0 -9.4930 -6.3320 -3.5200 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0040 1.8800 0.0030 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5460 1.8640 -0.8730 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5290 1.8540 0.9070 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0250 -0.1640 2.1340 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0580 -2.6260 2.1240 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0170 -2.6020 -2.1490 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0270 -0.1420 -2.1310 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.8440 -4.4880 -1.8440 H 0 0 0 0 0 0 0 0 0 0 0 0 0.9350 -4.4630 -1.8610 H 0 0 0 0 0 0 0 0 0 0 0 0 0.9780 -6.5720 -0.5580 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.8020 -6.5970 -0.5410 H 0 0 0 0 0 0 0 0 0 0 0 0 2.9050 -6.6780 -1.9840 H 0 0 0 0 0 0 0 0 0 0 0 0 4.5080 -7.4820 -3.6400 H 0 0 0 0 0 0 0 0 0 0 0 0 3.7330 -8.5430 -5.7180 H 0 0 0 0 0 0 0 0 0 0 0 0 1.3300 -8.8070 -6.1580 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.5530 -7.6230 -1.6530 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.5910 -6.0330 -2.4530 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.2550 -8.4390 -5.1260 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.6570 -8.2430 -4.6250 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.7360 -6.3530 -0.9140 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.3320 -6.5540 -1.4030 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.9550 -9.1590 -1.6230 H 0 0 0 0 0 0 0 0 0 0 0 0 -10.5040 -8.4780 -2.1760 H 0 0 0 0 0 0 0 0 0 0 0 0 -9.3070 -9.0480 -3.3640 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.5520 -5.4950 -1.1020 H 0 0 0 0 0 0 0 0 0 0 0 0 -10.0630 -6.4040 -0.8550 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.5140 -7.0850 -0.3020 H 0 0 0 0 0 0 0 0 0 0 0 0 -9.3600 -6.8160 -4.4880 H 0 0 0 0 0 0 0 0 0 0 0 0 -10.5570 -6.2470 -3.3000 H 0 0 0 0 0 0 0 0 0 0 0 0 -9.0460 -5.3380 -3.5460 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 33 1 0 0 0 0 1 34 1 0 0 0 0 1 35 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 36 1 0 0 0 0 4 5 1 0 0 0 0 4 37 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 38 1 0 0 0 0 7 39 1 0 0 0 0 8 9 1 0 0 0 0 9 10 1 0 0 0 0 9 40 1 0 0 0 0 9 41 1 0 0 0 0 10 11 1 0 0 0 0 10 42 1 0 0 0 0 10 43 1 0 0 0 0 11 12 1 0 0 0 0 11 20 2 0 0 0 0 12 13 1 0 0 0 0 12 17 2 0 0 0 0 13 14 2 0 0 0 0 13 44 1 0 0 0 0 14 15 1 0 0 0 0 14 45 1 0 0 0 0 15 16 2 0 0 0 0 15 46 1 0 0 0 0 16 17 1 0 0 0 0 16 47 1 0 0 0 0 17 18 1 0 0 0 0 18 19 1 0 0 0 0 18 20 1 0 0 0 0 20 21 1 0 0 0 0 21 22 1 0 0 0 0 21 48 1 0 0 0 0 21 49 1 0 0 0 0 22 23 1 0 0 0 0 23 24 1 0 0 0 0 23 28 2 0 0 0 0 24 25 2 0 0 0 0 24 50 1 0 0 0 0 25 26 1 0 0 0 0 25 51 1 0 0 0 0 26 27 2 0 0 0 0 26 29 1 0 0 0 0 27 28 1 0 0 0 0 27 52 1 0 0 0 0 28 53 1 0 0 0 0 29 30 1 0 0 0 0 29 31 1 0 0 0 0 29 32 1 0 0 0 0 30 54 1 0 0 0 0 30 55 1 0 0 0 0 30 56 1 0 0 0 0 31 57 1 0 0 0 0 31 58 1 0 0 0 0 31 59 1 0 0 0 0 32 60 1 0 0 0 0 32 61 1 0 0 0 0 32 62 1 0 0 0 0 M CHG 1 11 1 M END