PUBCHEM-ZINC05729558 MOE2007 3D CORINA 3.40 0006 02.08.2006 42 44 0 0 0 0 0 0 0 0999 V2000 2.9280 1.4630 2.1060 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2750 1.2900 3.8680 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.2090 1.4970 4.1870 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.5410 2.9130 3.9720 N 0 0 0 0 0 0 0 0 0 0 0 0 -0.1640 3.5300 2.6910 C 0 0 0 0 0 0 0 0 0 0 0 0 1.3190 3.2430 2.4300 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.1890 3.6450 4.9460 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.3420 5.1020 4.7940 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.7350 5.9600 5.6960 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.0130 7.3370 5.6510 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.3290 8.3200 6.3480 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.9570 9.5940 5.9990 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.7180 10.9200 6.3750 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.4950 11.9210 5.8660 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.5230 11.6320 4.9780 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.7780 10.3350 4.5940 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.9980 9.2970 5.0980 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.0120 7.9350 4.8970 N 0 0 0 0 0 0 0 0 0 0 0 0 -2.6300 7.4630 4.3160 H 0 0 0 0 0 0 0 0 0 0 0 0 0.7180 8.1370 7.1900 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.1170 5.6300 3.7120 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.7330 6.0500 2.8550 N 0 0 0 0 0 0 0 0 0 0 0 0 3.0540 0.3800 2.1070 H 0 0 0 0 0 0 0 0 0 0 0 0 3.6360 1.9120 2.8030 H 0 0 0 0 0 0 0 0 0 0 0 0 3.1100 1.8490 1.1030 H 0 0 0 0 0 0 0 0 0 0 0 0 1.8820 1.8320 4.5930 H 0 0 0 0 0 0 0 0 0 0 0 0 1.5130 0.2280 3.9150 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.8150 0.8750 3.5280 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.4010 1.2290 5.2260 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.7650 3.1030 1.8880 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.3250 4.6060 2.7410 H 0 0 0 0 0 0 0 0 0 0 0 0 1.5880 3.5970 1.4350 H 0 0 0 0 0 0 0 0 0 0 0 0 1.9250 3.7580 3.1760 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0490 5.5710 6.4340 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0800 11.1520 7.0660 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.3090 12.9440 6.1570 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.1300 12.4350 4.5850 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.5800 10.1220 3.9030 H 0 0 0 0 0 0 0 0 0 0 0 0 1.5820 8.1750 6.7570 H 0 0 0 0 0 0 0 0 0 0 0 0 1.5580 1.7960 2.5180 N 0 0 0 0 0 0 0 0 0 0 0 0 -1.6660 3.0450 6.0040 N 0 0 0 0 0 0 0 0 0 0 0 0 -2.1220 3.5590 6.6890 H 0 0 0 0 0 0 0 0 0 0 0 0 1 23 1 0 0 0 0 1 24 1 0 0 0 0 1 25 1 0 0 0 0 1 40 1 0 0 0 0 2 3 1 0 0 0 0 2 26 1 0 0 0 0 2 27 1 0 0 0 0 2 40 1 0 0 0 0 3 4 1 0 0 0 0 3 28 1 0 0 0 0 3 29 1 0 0 0 0 4 5 1 0 0 0 0 4 7 1 0 0 0 0 5 6 1 0 0 0 0 5 30 1 0 0 0 0 5 31 1 0 0 0 0 6 32 1 0 0 0 0 6 33 1 0 0 0 0 6 40 1 0 0 0 0 7 8 1 0 0 0 0 7 41 2 0 0 0 0 8 9 2 0 0 0 0 8 21 1 0 0 0 0 9 10 1 0 0 0 0 9 34 1 0 0 0 0 10 11 2 0 0 0 0 10 18 1 0 0 0 0 11 12 1 0 0 0 0 11 20 1 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 35 1 0 0 0 0 14 15 1 0 0 0 0 14 36 1 0 0 0 0 15 16 2 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 17 18 1 0 0 0 0 18 19 1 0 0 0 0 20 39 1 0 0 0 0 21 22 3 0 0 0 0 41 42 1 0 0 0 0 M END