PUBCHEM-ZINC00218661 MOE2007 3D CORINA 3.40 0006 02.08.2006 48 50 0 0 1 0 0 0 0 0999 V2000 -1.5090 0.5890 1.2520 C 0 0 0 0 0 0 0 0 0 0 0 0 0.7960 1.5080 1.2580 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.1930 3.0410 1.6030 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.4560 4.1080 2.4240 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.1070 5.4050 2.3750 N 0 0 0 0 0 0 0 0 0 0 0 0 -2.2980 5.6380 3.0380 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.8840 4.7640 3.6710 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.8220 7.0550 2.8730 C 0 0 3 0 0 0 0 0 0 0 0 0 -1.9700 7.7450 2.9330 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.8190 7.4250 3.9800 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.3950 8.8240 3.7470 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.0100 8.9510 2.3530 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.0400 8.5250 1.3520 N 0 0 0 0 0 0 0 0 0 0 0 0 -3.4840 7.1870 1.4950 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.7030 9.3560 0.3360 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.1450 10.5750 0.0810 N 0 0 0 0 0 0 0 0 0 0 0 0 -3.4770 10.9480 -1.0560 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.5220 12.1270 -1.8120 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.7030 12.2130 -2.9490 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.8640 11.1540 -3.3180 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.8090 9.9710 -2.5720 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.6350 9.9260 -1.4560 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.7730 8.9020 -0.5690 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.0690 -0.3850 1.4810 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.6010 0.7350 0.1720 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.4800 0.6800 1.7460 H 0 0 0 0 0 0 0 0 0 0 0 0 0.7780 1.7390 0.1900 H 0 0 0 0 0 0 0 0 0 0 0 0 1.1210 0.4790 1.4300 H 0 0 0 0 0 0 0 0 0 0 0 0 1.4550 2.1900 1.8000 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.2430 2.9760 1.9080 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.1590 3.2650 0.5300 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.3910 3.8010 3.4740 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5610 4.2560 2.0490 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.6620 6.1580 1.8580 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.6410 6.6980 4.0140 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.3250 7.3860 4.9580 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.1510 9.0460 4.5080 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.5940 9.5650 3.8620 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.9020 8.3170 2.2800 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.3450 9.9850 2.2060 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.7560 6.9440 0.7110 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.2910 6.4500 1.3880 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.1720 12.9460 -1.5240 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.7220 13.1190 -3.5520 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.2410 11.2520 -4.2050 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.1670 9.1430 -2.8450 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5990 1.6580 1.8050 N 0 3 0 0 0 0 0 0 0 0 0 0 -0.5480 1.4830 2.8190 H 0 0 0 0 0 0 0 0 0 0 0 0 1 24 1 0 0 0 0 1 25 1 0 0 0 0 1 26 1 0 0 0 0 1 47 1 0 0 0 0 2 27 1 0 0 0 0 2 28 1 0 0 0 0 2 29 1 0 0 0 0 2 47 1 0 0 0 0 3 4 1 0 0 0 0 3 30 1 0 0 0 0 3 31 1 0 0 0 0 3 47 1 0 0 0 0 4 5 1 0 0 0 0 4 32 1 0 0 0 0 4 33 1 0 0 0 0 5 6 1 0 0 0 0 5 34 1 0 0 0 0 6 7 2 0 0 0 0 6 8 1 0 0 0 0 8 9 1 0 0 0 0 8 10 1 0 0 0 0 8 14 1 0 0 0 0 10 11 1 0 0 0 0 10 35 1 0 0 0 0 10 36 1 0 0 0 0 11 12 1 0 0 0 0 11 37 1 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 12 40 1 0 0 0 0 13 14 1 0 0 0 0 13 15 1 0 0 0 0 14 41 1 0 0 0 0 14 42 1 0 0 0 0 15 16 2 0 0 0 0 15 23 1 0 0 0 0 16 17 1 0 0 0 0 17 18 1 0 0 0 0 17 22 2 0 0 0 0 18 19 2 0 0 0 0 18 43 1 0 0 0 0 19 20 1 0 0 0 0 19 44 1 0 0 0 0 20 21 2 0 0 0 0 20 45 1 0 0 0 0 21 22 1 0 0 0 0 21 46 1 0 0 0 0 22 23 1 0 0 0 0 47 48 1 0 0 0 0 M CHG 1 47 1 M END