PUBCHEM-ZINC05028008 MOE2007 3D CORINA 3.40 0006 02.08.2006 48 50 0 0 0 0 0 0 0 0999 V2000 2.1330 1.3990 0.7450 C 0 0 0 0 0 0 0 0 0 0 0 0 2.1450 0.0180 0.7410 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2070 -0.6810 0.0040 C 0 0 0 0 0 0 0 0 0 0 0 0 0.2540 0.0000 -0.7310 C 0 0 0 0 0 0 0 0 0 0 0 0 0.2360 1.3810 -0.7310 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1770 2.0860 0.0080 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1620 3.4840 0.0100 N 0 0 0 0 0 0 0 0 0 0 0 0 2.3180 4.1710 0.1040 C 0 0 0 0 0 0 0 0 0 0 0 0 3.3800 3.5780 0.0910 O 0 0 0 0 0 0 0 0 0 0 0 0 2.2960 5.6410 0.2230 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0760 6.3240 0.2380 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0580 7.6950 0.3500 C 0 0 0 0 0 0 0 0 0 0 0 0 2.2540 8.4020 0.4480 C 0 0 0 0 0 0 0 0 0 0 0 0 3.4700 7.7250 0.4320 C 0 0 0 0 0 0 0 0 0 0 0 0 3.4940 6.3530 0.3270 C 0 0 0 0 0 0 0 0 0 0 0 0 4.7380 8.4810 0.5350 N 0 3 0 0 0 0 0 0 0 0 0 0 5.8030 7.8900 0.5220 O 0 0 0 0 0 0 0 0 0 0 0 0 4.7170 9.6950 0.6330 O 0 5 0 0 0 0 0 0 0 0 0 0 2.2320 9.7880 0.5600 N 0 0 0 0 0 0 0 0 0 0 0 0 1.5000 10.2080 1.7620 C 0 0 0 0 0 0 0 0 0 0 0 0 1.6210 11.7240 1.9320 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0470 12.4180 0.6930 C 0 0 0 0 0 0 0 0 0 0 0 0 1.7950 11.9280 -0.5500 C 0 0 0 0 0 0 0 0 0 0 0 0 1.6690 10.4060 -0.6470 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2260 -2.4430 0.0010 S 0 0 0 0 0 0 0 0 0 0 0 0 0.5790 -2.8490 -1.1960 O 0 0 0 0 0 0 0 0 0 0 0 0 2.5520 -2.8300 0.3380 O 0 0 0 0 0 0 0 0 0 0 0 0 0.2610 -2.9460 1.2490 N 0 0 0 0 0 0 0 0 0 0 0 0 2.8640 1.9450 1.3240 H 0 0 0 0 0 0 0 0 0 0 0 0 2.8880 -0.5160 1.3140 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.4780 -0.5490 -1.3050 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5090 1.9120 -1.3050 H 0 0 0 0 0 0 0 0 0 0 0 0 0.3200 3.9610 -0.0570 H 0 0 0 0 0 0 0 0 0 0 0 0 0.1480 5.7760 0.1620 H 0 0 0 0 0 0 0 0 0 0 0 0 0.1160 8.2230 0.3620 H 0 0 0 0 0 0 0 0 0 0 0 0 4.4380 5.8280 0.3200 H 0 0 0 0 0 0 0 0 0 0 0 0 0.4490 9.9360 1.6600 H 0 0 0 0 0 0 0 0 0 0 0 0 1.9210 9.7100 2.6360 H 0 0 0 0 0 0 0 0 0 0 0 0 1.0640 12.0370 2.8150 H 0 0 0 0 0 0 0 0 0 0 0 0 2.6700 11.9940 2.0470 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0120 12.1790 0.5990 H 0 0 0 0 0 0 0 0 0 0 0 0 1.1710 13.4970 0.7910 H 0 0 0 0 0 0 0 0 0 0 0 0 1.3630 12.3860 -1.4390 H 0 0 0 0 0 0 0 0 0 0 0 0 2.8470 12.2020 -0.4730 H 0 0 0 0 0 0 0 0 0 0 0 0 2.2120 10.0520 -1.5230 H 0 0 0 0 0 0 0 0 0 0 0 0 0.6180 10.1330 -0.7380 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.1840 -2.2930 1.8120 H 0 0 0 0 0 0 0 0 0 0 0 0 0.1400 -3.8930 1.4170 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 6 2 0 0 0 0 1 29 1 0 0 0 0 2 3 2 0 0 0 0 2 30 1 0 0 0 0 3 4 1 0 0 0 0 3 25 1 0 0 0 0 4 5 2 0 0 0 0 4 31 1 0 0 0 0 5 6 1 0 0 0 0 5 32 1 0 0 0 0 6 7 1 0 0 0 0 7 8 1 0 0 0 0 7 33 1 0 0 0 0 8 9 2 0 0 0 0 8 10 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 34 1 0 0 0 0 12 13 1 0 0 0 0 12 35 1 0 0 0 0 13 14 2 0 0 0 0 13 19 1 0 0 0 0 14 15 1 0 0 0 0 14 16 1 0 0 0 0 15 36 1 0 0 0 0 16 17 2 0 0 0 0 16 18 1 0 0 0 0 19 20 1 0 0 0 0 19 24 1 0 0 0 0 20 21 1 0 0 0 0 20 37 1 0 0 0 0 20 38 1 0 0 0 0 21 22 1 0 0 0 0 21 39 1 0 0 0 0 21 40 1 0 0 0 0 22 23 1 0 0 0 0 22 41 1 0 0 0 0 22 42 1 0 0 0 0 23 24 1 0 0 0 0 23 43 1 0 0 0 0 23 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 27 2 0 0 0 0 25 28 1 0 0 0 0 28 47 1 0 0 0 0 28 48 1 0 0 0 0 M CHG 1 16 1 M CHG 1 18 -1 M END