PUBCHEM-ZINC03024596 MOE2007 3D CORINA 3.40 0006 02.08.2006 47 49 0 0 1 0 0 0 0 0999 V2000 -0.2820 2.0530 4.4200 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.1060 0.5630 4.6670 C 0 0 0 0 0 0 0 0 0 0 0 0 0.5640 -0.1260 3.4780 C 0 0 0 0 0 0 0 0 0 0 0 0 0.7370 -1.6260 3.7310 C 0 0 0 0 0 0 0 0 0 0 0 0 1.4050 -2.3160 2.5370 C 0 0 0 0 0 0 0 0 0 0 0 0 1.6100 -3.8410 2.6690 C 0 0 3 0 0 0 0 0 0 0 0 0 2.1450 -4.1620 1.7640 H 0 0 0 0 0 0 0 0 0 0 0 0 2.4650 -4.2090 3.8340 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0240 -4.6760 5.0480 C 0 0 0 0 0 0 0 0 0 0 0 0 3.1580 -4.8940 5.8740 C 0 0 0 0 0 0 0 0 0 0 0 0 3.3470 -5.3430 7.1960 C 0 0 0 0 0 0 0 0 0 0 0 0 4.6460 -5.4390 7.7100 C 0 0 0 0 0 0 0 0 0 0 0 0 5.7480 -5.0950 6.9280 C 0 0 0 0 0 0 0 0 0 0 0 0 5.5850 -4.6470 5.6120 C 0 0 0 0 0 0 0 0 0 0 0 0 4.2800 -4.5540 5.1120 C 0 0 0 0 0 0 0 0 0 0 0 0 3.8300 -4.1450 3.8730 N 0 0 0 0 0 0 0 0 0 0 0 0 4.4270 -3.8440 3.1160 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5740 -4.8420 5.2950 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.1600 -5.2350 3.9890 C 0 0 3 0 0 0 0 0 0 0 0 0 -0.0410 -6.3170 3.8420 H 0 0 0 0 0 0 0 0 0 0 0 0 0.3480 -4.6200 2.7010 N 0 0 0 0 0 0 0 0 0 0 0 0 -0.2940 -4.8080 1.4730 C 0 0 0 0 0 0 0 0 0 0 0 0 0.1030 -4.2910 0.4230 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.5040 -5.7100 1.4290 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.6300 -4.9460 4.3870 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.1000 -3.8280 4.0380 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.9090 2.2340 3.5410 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.7630 2.5260 5.2820 H 0 0 0 0 0 0 0 0 0 0 0 0 0.6840 2.5420 4.2600 H 0 0 0 0 0 0 0 0 0 0 0 0 0.4970 0.4170 5.5700 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0870 0.1120 4.8550 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0420 0.0270 2.5760 H 0 0 0 0 0 0 0 0 0 0 0 0 1.5430 0.3310 3.2910 H 0 0 0 0 0 0 0 0 0 0 0 0 1.3410 -1.7650 4.6350 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.2430 -2.0700 3.9180 H 0 0 0 0 0 0 0 0 0 0 0 0 0.8120 -2.1070 1.6390 H 0 0 0 0 0 0 0 0 0 0 0 0 2.3840 -1.8470 2.3730 H 0 0 0 0 0 0 0 0 0 0 0 0 2.4940 -5.6130 7.8120 H 0 0 0 0 0 0 0 0 0 0 0 0 4.7930 -5.7840 8.7300 H 0 0 0 0 0 0 0 0 0 0 0 0 6.7490 -5.1760 7.3450 H 0 0 0 0 0 0 0 0 0 0 0 0 6.4420 -4.3790 5.0050 H 0 0 0 0 0 0 0 0 0 0 0 0 0.4030 -5.6070 6.0630 H 0 0 0 0 0 0 0 0 0 0 0 0 0.1900 -3.8970 5.7020 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.3950 -5.1570 1.7330 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.6530 -6.0500 0.3990 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.3720 -6.6000 2.0460 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.1930 -5.8870 5.0190 O 0 5 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 27 1 0 0 0 0 1 28 1 0 0 0 0 1 29 1 0 0 0 0 2 3 1 0 0 0 0 2 30 1 0 0 0 0 2 31 1 0 0 0 0 3 4 1 0 0 0 0 3 32 1 0 0 0 0 3 33 1 0 0 0 0 4 5 1 0 0 0 0 4 34 1 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 5 37 1 0 0 0 0 6 7 1 0 0 0 0 6 8 1 0 0 0 0 6 21 1 0 0 0 0 8 9 2 0 0 0 0 8 16 1 0 0 0 0 9 10 1 0 0 0 0 9 18 1 0 0 0 0 10 11 1 0 0 0 0 10 15 2 0 0 0 0 11 12 2 0 0 0 0 11 38 1 0 0 0 0 12 13 1 0 0 0 0 12 39 1 0 0 0 0 13 14 2 0 0 0 0 13 40 1 0 0 0 0 14 15 1 0 0 0 0 14 41 1 0 0 0 0 15 16 1 0 0 0 0 16 17 1 0 0 0 0 18 19 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 19 21 1 0 0 0 0 19 25 1 0 0 0 0 21 22 1 0 0 0 0 22 23 2 0 0 0 0 22 24 1 0 0 0 0 24 44 1 0 0 0 0 24 45 1 0 0 0 0 24 46 1 0 0 0 0 25 26 2 0 0 0 0 25 47 1 0 0 0 0 M CHG 1 47 -1 M END