PUBCHEM-ZINC05633415 MOE2007 3D CORINA 3.40 0006 02.08.2006 45 45 0 0 1 0 0 0 0 0999 V2000 1.0790 1.6380 1.0380 C 0 0 0 0 0 0 0 0 0 0 0 0 0.5640 0.3470 0.3860 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1910 0.2340 -1.0110 C 0 0 0 0 0 0 0 0 0 0 0 0 0.8420 -0.9080 1.2560 C 0 0 3 0 0 0 0 0 0 0 0 0 1.9210 -1.0650 1.3670 H 0 0 0 0 0 0 0 0 0 0 0 0 0.2010 -2.1470 0.5490 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.0080 -2.3570 0.8740 O 0 0 0 0 0 0 0 0 0 0 0 0 0.2590 -0.7640 2.6070 N 0 0 0 0 0 0 0 0 0 0 0 0 0.9260 -0.2840 3.7080 C 0 0 0 0 0 0 0 0 0 0 0 0 2.1080 0.0630 3.7120 O 0 0 0 0 0 0 0 0 0 0 0 0 0.0650 -0.2160 4.9660 C 0 0 0 0 0 0 0 0 0 0 0 0 0.8420 0.3900 6.0300 N 0 0 0 0 0 0 0 0 0 0 0 0 0.3160 0.6830 7.2620 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.8490 0.4740 7.5800 O 0 0 0 0 0 0 0 0 0 0 0 0 1.2580 1.2420 8.0960 N 0 0 0 0 0 0 0 0 0 0 0 0 0.9570 1.6540 9.4590 C 0 0 0 0 0 0 0 0 0 0 0 0 1.8610 2.8190 9.8760 C 0 0 0 0 0 0 0 0 0 0 0 0 1.6140 3.2340 11.3240 C 0 0 0 0 0 0 0 0 0 0 0 0 1.7560 2.0530 12.2800 C 0 0 0 0 0 0 0 0 0 0 0 0 0.8600 0.8870 11.8710 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1040 0.4690 10.4230 C 0 0 0 0 0 0 0 0 0 0 0 0 2.1500 1.5710 1.2580 H 0 0 0 0 0 0 0 0 0 0 0 0 0.9250 2.4970 0.3770 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5450 1.8570 1.9680 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5210 0.4580 0.2560 H 0 0 0 0 0 0 0 0 0 0 0 0 2.2660 0.0340 -0.9480 H 0 0 0 0 0 0 0 0 0 0 0 0 0.7250 -0.5630 -1.5980 H 0 0 0 0 0 0 0 0 0 0 0 0 1.0540 1.1620 -1.5780 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.7070 -1.0880 2.6590 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.8270 0.3910 4.7820 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.2300 -1.2240 5.2730 H 0 0 0 0 0 0 0 0 0 0 0 0 1.8120 0.5910 5.8160 H 0 0 0 0 0 0 0 0 0 0 0 0 2.1980 1.3500 7.7440 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0870 1.9950 9.4830 H 0 0 0 0 0 0 0 0 0 0 0 0 2.9150 2.5360 9.7550 H 0 0 0 0 0 0 0 0 0 0 0 0 1.6930 3.6780 9.2150 H 0 0 0 0 0 0 0 0 0 0 0 0 2.3190 4.0240 11.6070 H 0 0 0 0 0 0 0 0 0 0 0 0 0.6060 3.6580 11.4150 H 0 0 0 0 0 0 0 0 0 0 0 0 2.8020 1.7210 12.2960 H 0 0 0 0 0 0 0 0 0 0 0 0 1.5070 2.3700 13.2980 H 0 0 0 0 0 0 0 0 0 0 0 0 1.0390 0.0350 12.5350 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.1910 1.1740 11.9950 H 0 0 0 0 0 0 0 0 0 0 0 0 0.4020 -0.3280 10.1520 H 0 0 0 0 0 0 0 0 0 0 0 0 2.1100 0.0390 10.3320 H 0 0 0 0 0 0 0 0 0 0 0 0 0.9580 -2.7950 -0.2270 O 0 5 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 4 1 0 0 0 0 2 25 1 0 0 0 0 3 26 1 0 0 0 0 3 27 1 0 0 0 0 3 28 1 0 0 0 0 4 5 1 0 0 0 0 4 6 1 0 0 0 0 4 8 1 0 0 0 0 6 7 2 0 0 0 0 6 45 1 0 0 0 0 8 9 1 0 0 0 0 8 29 1 0 0 0 0 9 10 2 0 0 0 0 9 11 1 0 0 0 0 11 12 1 0 0 0 0 11 30 1 0 0 0 0 11 31 1 0 0 0 0 12 13 1 0 0 0 0 12 32 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 33 1 0 0 0 0 16 17 1 0 0 0 0 16 21 1 0 0 0 0 16 34 1 0 0 0 0 17 18 1 0 0 0 0 17 35 1 0 0 0 0 17 36 1 0 0 0 0 18 19 1 0 0 0 0 18 37 1 0 0 0 0 18 38 1 0 0 0 0 19 20 1 0 0 0 0 19 39 1 0 0 0 0 19 40 1 0 0 0 0 20 21 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 M CHG 1 45 -1 M END