PUBCHEM-ZINC06032003 MOE2007 3D CORINA 3.40 0006 02.08.2006 56 57 0 0 1 0 0 0 0 0999 V2000 2.0430 2.2380 -1.5320 C 0 0 0 0 0 0 0 0 0 0 0 0 1.5040 0.8480 -1.1870 C 0 0 3 0 0 0 0 0 0 0 0 0 2.0590 0.2810 0.1470 C 0 0 3 0 0 0 0 0 0 0 0 0 1.6920 0.9270 0.9580 H 0 0 0 0 0 0 0 0 0 0 0 0 3.5980 0.2840 0.2070 C 0 0 0 0 0 0 0 0 0 0 0 0 4.1010 -0.1930 1.5680 C 0 0 0 0 0 0 0 0 0 0 0 0 3.6630 -1.6270 1.9370 C 0 0 3 0 0 0 0 0 0 0 0 0 3.8640 -1.7130 3.0150 H 0 0 0 0 0 0 0 0 0 0 0 0 2.1090 -1.7150 1.7820 C 0 0 3 0 0 0 0 0 0 0 0 0 1.6840 -1.0620 2.5600 H 0 0 0 0 0 0 0 0 0 0 0 0 1.5660 -1.1540 0.4410 C 0 0 0 0 0 0 0 0 0 0 0 0 1.5640 -3.1260 2.0510 C 0 0 0 0 0 0 0 0 0 0 0 0 0.1450 -3.0650 2.2180 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.4820 -4.2470 2.5020 C 0 0 0 0 0 0 0 0 0 0 0 0 0.1170 -5.5040 2.5750 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.6540 -6.6300 2.8730 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.0250 -6.5040 3.0970 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.6420 -5.2460 3.0280 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.8550 -4.1250 2.7290 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.0840 -5.0970 3.2600 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.6340 -5.6860 4.3050 N 0 3 0 0 0 0 0 0 0 0 0 0 -4.0540 -6.2100 4.9510 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.6230 -5.6120 4.5060 H 0 0 0 0 0 0 0 0 0 0 0 0 4.4970 -2.7600 1.2630 C 0 0 3 0 0 0 0 0 0 0 0 0 5.9950 -2.4640 1.1430 C 0 0 0 0 0 0 0 0 0 0 0 0 4.5070 -4.1350 2.0360 C 0 0 0 0 0 0 0 0 0 0 0 0 4.7120 -4.1180 3.2780 O 0 0 0 0 0 0 0 0 0 0 0 0 4.0140 -3.0460 -0.0650 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.0560 1.0170 -1.2170 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.5900 1.7800 -0.3680 O 0 0 0 0 0 0 0 0 0 0 0 0 1.8460 -0.0260 -2.2880 O 0 0 0 0 0 0 0 0 0 0 0 0 3.0950 2.1950 -1.8330 H 0 0 0 0 0 0 0 0 0 0 0 0 1.5090 2.6700 -2.3880 H 0 0 0 0 0 0 0 0 0 0 0 0 1.9450 2.9330 -0.6910 H 0 0 0 0 0 0 0 0 0 0 0 0 4.0180 -0.3390 -0.5920 H 0 0 0 0 0 0 0 0 0 0 0 0 3.9810 1.2990 0.0530 H 0 0 0 0 0 0 0 0 0 0 0 0 5.1880 -0.0760 1.6230 H 0 0 0 0 0 0 0 0 0 0 0 0 3.7070 0.4910 2.3330 H 0 0 0 0 0 0 0 0 0 0 0 0 0.4700 -1.1510 0.4740 H 0 0 0 0 0 0 0 0 0 0 0 0 1.8440 -1.8220 -0.3820 H 0 0 0 0 0 0 0 0 0 0 0 0 1.7980 -3.7850 1.2090 H 0 0 0 0 0 0 0 0 0 0 0 0 2.0060 -3.5080 2.9780 H 0 0 0 0 0 0 0 0 0 0 0 0 1.1820 -5.6440 2.4020 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.1790 -7.6080 2.9210 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.6040 -7.4010 3.3050 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.2970 -3.1310 2.6830 H 0 0 0 0 0 0 0 0 0 0 0 0 6.4280 -2.1530 2.1000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.5530 -3.3420 0.7920 H 0 0 0 0 0 0 0 0 0 0 0 0 6.1860 -1.6850 0.3960 H 0 0 0 0 0 0 0 0 0 0 0 0 3.9970 -4.0410 -0.0690 H 0 0 0 0 0 0 0 0 0 0 0 0 0.9470 -0.2330 -2.6640 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.8030 -4.3730 2.4230 N 0 0 0 0 0 0 0 0 0 0 0 0 -4.3580 -3.9450 1.6160 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.7960 -4.2310 2.5460 H 0 0 0 0 0 0 0 0 0 0 0 0 4.2600 -5.1120 1.2530 O 0 5 0 0 0 0 0 0 0 0 0 0 -0.5820 0.3380 -2.1630 O 0 5 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 32 1 0 0 0 0 1 33 1 0 0 0 0 1 34 1 0 0 0 0 2 3 1 0 0 0 0 2 29 1 0 0 0 0 2 31 1 0 0 0 0 3 4 1 0 0 0 0 3 5 1 0 0 0 0 3 11 1 0 0 0 0 5 6 1 0 0 0 0 5 35 1 0 0 0 0 5 36 1 0 0 0 0 6 7 1 0 0 0 0 6 37 1 0 0 0 0 6 38 1 0 0 0 0 7 8 1 0 0 0 0 7 9 1 0 0 0 0 7 24 1 0 0 0 0 9 10 1 0 0 0 0 9 11 1 0 0 0 0 9 12 1 0 0 0 0 11 39 1 0 0 0 0 11 40 1 0 0 0 0 12 13 1 0 0 0 0 12 41 1 0 0 0 0 12 42 1 0 0 0 0 13 14 1 0 0 0 0 14 15 1 0 0 0 0 14 19 2 0 0 0 0 15 16 2 0 0 0 0 15 43 1 0 0 0 0 16 17 1 0 0 0 0 16 44 1 0 0 0 0 17 18 2 0 0 0 0 17 45 1 0 0 0 0 18 19 1 0 0 0 0 18 20 1 0 0 0 0 19 46 1 0 0 0 0 20 21 2 0 0 0 0 20 52 1 0 0 0 0 21 22 1 0 0 0 0 21 23 1 0 0 0 0 24 25 1 0 0 0 0 24 26 1 0 0 0 0 24 28 1 0 0 0 0 25 47 1 0 0 0 0 25 48 1 0 0 0 0 25 49 1 0 0 0 0 26 27 2 0 0 0 0 26 55 1 0 0 0 0 28 50 1 0 0 0 0 29 30 2 0 0 0 0 29 56 1 0 0 0 0 31 51 1 0 0 0 0 52 53 1 0 0 0 0 52 54 1 0 0 0 0 M CHG 1 21 1 M CHG 1 55 -1 M CHG 1 56 -1 M END