PUBCHEM-ZINC05298597 MOE2007 3D CORINA 3.40 0006 02.08.2006 47 49 0 0 1 0 0 0 0 0999 V2000 1.6690 -4.3170 2.7360 C 0 0 0 0 0 0 0 0 0 0 0 0 0.9860 -3.3950 1.7390 C 0 0 0 0 0 0 0 0 0 0 0 0 1.6550 -3.4640 0.3640 C 0 0 0 0 0 0 0 0 0 0 0 0 0.9640 -2.5290 -0.6350 C 0 0 0 0 0 0 0 0 0 0 0 0 1.5660 -2.4970 -2.0570 C 0 0 3 0 0 0 0 0 0 0 0 0 0.9150 -1.8420 -2.6530 H 0 0 0 0 0 0 0 0 0 0 0 0 1.5560 -3.8330 -2.7190 C 0 0 0 0 0 0 0 0 0 0 0 0 2.6260 -4.6870 -2.8370 C 0 0 0 0 0 0 0 0 0 0 0 0 2.1870 -5.8490 -3.5240 C 0 0 0 0 0 0 0 0 0 0 0 0 2.8020 -7.0520 -3.9260 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0470 -8.0150 -4.6060 C 0 0 0 0 0 0 0 0 0 0 0 0 0.7000 -7.7940 -4.8890 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0680 -6.6070 -4.5010 C 0 0 0 0 0 0 0 0 0 0 0 0 0.8340 -5.6540 -3.8200 C 0 0 0 0 0 0 0 0 0 0 0 0 0.4770 -4.4170 -3.3220 N 0 0 0 0 0 0 0 0 0 0 0 0 -0.4460 -4.0130 -3.3960 H 0 0 0 0 0 0 0 0 0 0 0 0 3.9380 -4.3130 -2.2630 C 0 0 0 0 0 0 0 0 0 0 0 0 4.1470 -2.7800 -2.3300 C 0 0 3 0 0 0 0 0 0 0 0 0 4.4990 -2.5280 -3.3390 H 0 0 0 0 0 0 0 0 0 0 0 0 2.9260 -1.9070 -2.1260 N 0 0 0 0 0 0 0 0 0 0 0 0 2.9930 -0.5070 -2.0710 C 0 0 0 0 0 0 0 0 0 0 0 0 1.9910 0.1930 -1.8880 O 0 0 0 0 0 0 0 0 0 0 0 0 4.3540 0.1460 -2.2800 C 0 0 0 0 0 0 0 0 0 0 0 0 4.2390 1.6370 -2.5610 C 0 0 0 0 0 0 0 0 0 0 0 0 5.3230 -2.6100 -1.3360 C 0 0 0 0 0 0 0 0 0 0 0 0 5.0190 -2.3200 -0.1450 O 0 0 0 0 0 0 0 0 0 0 0 0 1.6250 -5.3590 2.4010 H 0 0 0 0 0 0 0 0 0 0 0 0 2.7210 -4.0430 2.8670 H 0 0 0 0 0 0 0 0 0 0 0 0 1.1770 -4.2520 3.7110 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0700 -3.6750 1.6540 H 0 0 0 0 0 0 0 0 0 0 0 0 1.0200 -2.3670 2.1190 H 0 0 0 0 0 0 0 0 0 0 0 0 2.7070 -3.1880 0.4670 H 0 0 0 0 0 0 0 0 0 0 0 0 1.6180 -4.4980 0.0040 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0900 -2.8290 -0.7110 H 0 0 0 0 0 0 0 0 0 0 0 0 0.9640 -1.5150 -0.2190 H 0 0 0 0 0 0 0 0 0 0 0 0 3.8510 -7.2320 -3.7090 H 0 0 0 0 0 0 0 0 0 0 0 0 2.5190 -8.9440 -4.9150 H 0 0 0 0 0 0 0 0 0 0 0 0 0.1310 -8.5540 -5.4190 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9790 -6.4360 -4.7210 H 0 0 0 0 0 0 0 0 0 0 0 0 3.9690 -4.6790 -1.2270 H 0 0 0 0 0 0 0 0 0 0 0 0 4.7480 -4.8230 -2.7990 H 0 0 0 0 0 0 0 0 0 0 0 0 4.9510 0.0140 -1.3740 H 0 0 0 0 0 0 0 0 0 0 0 0 4.8680 -0.3240 -3.1230 H 0 0 0 0 0 0 0 0 0 0 0 0 5.2310 2.0700 -2.7280 H 0 0 0 0 0 0 0 0 0 0 0 0 3.6300 1.8230 -3.4520 H 0 0 0 0 0 0 0 0 0 0 0 0 3.7770 2.1640 -1.7200 H 0 0 0 0 0 0 0 0 0 0 0 0 6.4680 -2.7820 -1.8490 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 7 1 0 0 0 0 5 20 1 0 0 0 0 7 8 2 0 0 0 0 7 15 1 0 0 0 0 8 9 1 0 0 0 0 8 17 1 0 0 0 0 9 10 1 0 0 0 0 9 14 2 0 0 0 0 10 11 2 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 12 13 2 0 0 0 0 12 38 1 0 0 0 0 13 14 1 0 0 0 0 13 39 1 0 0 0 0 14 15 1 0 0 0 0 15 16 1 0 0 0 0 17 18 1 0 0 0 0 17 40 1 0 0 0 0 17 41 1 0 0 0 0 18 19 1 0 0 0 0 18 20 1 0 0 0 0 18 25 1 0 0 0 0 20 21 1 0 0 0 0 21 22 2 0 0 0 0 21 23 1 0 0 0 0 23 24 1 0 0 0 0 23 42 1 0 0 0 0 23 43 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