PUBCHEM-ZINC01852539 MOE2007 3D CORINA 3.40 0006 02.08.2006 48 50 0 0 1 0 0 0 0 0999 V2000 0.7600 3.5700 -0.9410 C 0 0 0 0 0 0 0 0 0 0 0 0 1.6410 1.5110 0.2080 C 0 0 0 0 0 0 0 0 0 0 0 0 1.3040 1.5290 1.6840 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.1900 1.2740 1.6930 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.7110 2.1470 0.5550 C 0 0 3 0 0 0 0 0 0 0 0 0 -0.8690 3.1780 0.8950 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.9760 1.5810 -0.1000 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.3910 2.4540 -1.1640 O 0 0 0 0 0 0 0 0 0 0 0 0 -3.3510 1.9350 -1.9860 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.8770 0.8370 -1.8180 O 0 0 0 0 0 0 0 0 0 0 0 0 -3.7350 2.8840 -3.1460 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.9860 3.7200 -2.8430 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.4000 4.0190 -1.5330 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.5410 4.7940 -1.3010 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.2840 5.2910 -2.3700 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.8850 5.0190 -3.6750 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.7460 4.2450 -3.9090 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.5300 3.6960 -3.6390 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.5670 3.0950 -4.4730 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.4440 3.8030 -4.9080 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.2570 5.1250 -4.5140 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.1910 5.7370 -3.6820 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.3130 5.0280 -3.2420 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.1170 1.9800 -4.2120 O 0 0 0 0 0 0 0 0 0 0 0 0 1.5230 3.4880 -1.7190 H 0 0 0 0 0 0 0 0 0 0 0 0 1.1200 4.1690 -0.1000 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.1560 3.9940 -1.3540 H 0 0 0 0 0 0 0 0 0 0 0 0 2.5630 2.0440 -0.0420 H 0 0 0 0 0 0 0 0 0 0 0 0 1.6780 0.4910 -0.1890 H 0 0 0 0 0 0 0 0 0 0 0 0 1.8600 0.7730 2.2450 H 0 0 0 0 0 0 0 0 0 0 0 0 1.5280 2.5110 2.1170 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.3910 0.2120 1.5040 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.6480 1.5360 2.6510 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.7780 0.5760 -0.4930 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.7820 1.5260 0.6400 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.8490 3.6620 -0.6660 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.8530 5.0110 -0.2820 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.1720 5.8910 -2.1860 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.4600 5.4080 -4.5120 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.4500 4.0500 -4.9390 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.6960 2.0660 -4.8060 H 0 0 0 0 0 0 0 0 0 0 0 0 0.2770 3.3250 -5.5660 H 0 0 0 0 0 0 0 0 0 0 0 0 0.6090 5.6800 -4.8630 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0510 6.7720 -3.3780 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.0170 5.5410 -2.5900 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.7780 1.3710 -3.8300 H 0 0 0 0 0 0 0 0 0 0 0 0 0.4530 2.1840 -0.4500 N 0 3 0 0 0 0 0 0 0 0 0 0 0.1940 1.6360 -1.2820 H 0 0 0 0 0 0 0 0 0 0 0 0 1 25 1 0 0 0 0 1 26 1 0 0 0 0 1 27 1 0 0 0 0 1 47 1 0 0 0 0 2 3 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 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 7 1 0 0 0 0 5 47 1 0 0 0 0 7 8 1 0 0 0 0 7 34 1 0 0 0 0 7 35 1 0 0 0 0 8 9 1 0 0 0 0 9 10 2 0 0 0 0 9 11 1 0 0 0 0 11 12 1 0 0 0 0 11 18 1 0 0 0 0 11 24 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 36 1 0 0 0 0 14 15 1 0 0 0 0 14 37 1 0 0 0 0 15 16 2 0 0 0 0 15 38 1 0 0 0 0 16 17 1 0 0 0 0 16 39 1 0 0 0 0 17 40 1 0 0 0 0 18 19 1 0 0 0 0 18 23 2 0 0 0 0 19 20 2 0 0 0 0 19 41 1 0 0 0 0 20 21 1 0 0 0 0 20 42 1 0 0 0 0 21 22 2 0 0 0 0 21 43 1 0 0 0 0 22 23 1 0 0 0 0 22 44 1 0 0 0 0 23 45 1 0 0 0 0 24 46 1 0 0 0 0 47 48 1 0 0 0 0 M CHG 1 47 1 M END