PUBCHEM-ZINC05408614 MOE2007 3D CORINA 3.40 0006 02.08.2006 55 57 0 0 1 0 0 0 0 0999 V2000 1.6510 -1.4790 2.6130 C 0 0 0 0 0 0 0 0 0 0 0 0 0.7490 -1.6790 1.4080 C 0 0 0 0 0 0 0 0 0 0 0 0 1.5590 -2.1240 0.3220 O 0 0 0 0 0 0 0 0 0 0 0 0 0.9150 -2.4470 -0.8410 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.4400 -2.2450 -1.1120 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.9740 -2.6300 -2.3450 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.1590 -3.2250 -3.3080 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1980 -3.4390 -3.0450 C 0 0 0 0 0 0 0 0 0 0 0 0 1.7310 -3.0290 -1.8160 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0440 -4.0860 -4.0520 C 0 0 0 0 0 0 0 0 0 0 0 0 2.4330 -5.3680 -3.9930 C 0 0 0 0 0 0 0 0 0 0 0 0 3.2320 -6.1520 -5.0170 C 0 0 3 0 0 0 0 0 0 0 0 0 2.6580 -6.1800 -5.9530 H 0 0 0 0 0 0 0 0 0 0 0 0 3.2460 -7.5150 -4.5010 N 0 0 0 0 0 0 0 0 0 0 0 0 2.6270 -7.6570 -3.2810 C 0 0 0 0 0 0 0 0 0 0 0 0 2.5290 -8.6590 -2.5950 O 0 0 0 0 0 0 0 0 0 0 0 0 2.0800 -6.3160 -2.9120 C 0 0 0 0 0 0 0 0 0 0 0 0 1.4640 -6.1190 -1.8780 O 0 0 0 0 0 0 0 0 0 0 0 0 3.8460 -8.6390 -5.2090 C 0 0 0 0 0 0 0 0 0 0 0 0 5.2260 -9.0160 -4.6490 C 0 0 0 0 0 0 0 0 0 0 0 0 6.0110 -10.3380 -6.6610 C 0 0 0 0 0 0 0 0 0 0 0 0 6.9000 -10.8470 -4.4010 C 0 0 0 0 0 0 0 0 0 0 0 0 4.6330 -5.6360 -5.2720 C 0 0 0 0 0 0 0 0 0 0 0 0 5.0920 -5.4950 -6.5890 C 0 0 0 0 0 0 0 0 0 0 0 0 6.3960 -5.0770 -6.8030 C 0 0 0 0 0 0 0 0 0 0 0 0 7.2670 -4.7980 -5.8120 N 0 0 0 0 0 0 0 0 0 0 0 0 6.8070 -4.9230 -4.5490 C 0 0 0 0 0 0 0 0 0 0 0 0 5.5200 -5.3350 -4.2300 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3560 -3.2350 -5.0910 O 0 0 0 0 0 0 0 0 0 0 0 0 2.1580 -2.4140 2.8750 H 0 0 0 0 0 0 0 0 0 0 0 0 2.4320 -0.7440 2.3920 H 0 0 0 0 0 0 0 0 0 0 0 0 1.0760 -1.1350 3.4770 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0120 -2.4300 1.6520 H 0 0 0 0 0 0 0 0 0 0 0 0 0.2710 -0.7260 1.1580 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.1060 -1.7890 -0.3890 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.0290 -2.4680 -2.5520 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5880 -3.5250 -4.2610 H 0 0 0 0 0 0 0 0 0 0 0 0 2.7850 -3.1800 -1.5980 H 0 0 0 0 0 0 0 0 0 0 0 0 3.1690 -9.4940 -5.0910 H 0 0 0 0 0 0 0 0 0 0 0 0 3.8920 -8.3970 -6.2750 H 0 0 0 0 0 0 0 0 0 0 0 0 5.9870 -8.2690 -4.8940 H 0 0 0 0 0 0 0 0 0 0 0 0 5.1750 -9.1170 -3.5590 H 0 0 0 0 0 0 0 0 0 0 0 0 6.7720 -9.5770 -6.8560 H 0 0 0 0 0 0 0 0 0 0 0 0 5.0870 -10.1200 -7.2000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.3700 -11.3310 -6.9450 H 0 0 0 0 0 0 0 0 0 0 0 0 6.6060 -10.9240 -3.3510 H 0 0 0 0 0 0 0 0 0 0 0 0 7.7210 -10.1360 -4.5290 H 0 0 0 0 0 0 0 0 0 0 0 0 7.1710 -11.8350 -4.7820 H 0 0 0 0 0 0 0 0 0 0 0 0 4.4550 -5.7130 -7.4410 H 0 0 0 0 0 0 0 0 0 0 0 0 6.7880 -4.9550 -7.8090 H 0 0 0 0 0 0 0 0 0 0 0 0 7.5240 -4.6780 -3.7710 H 0 0 0 0 0 0 0 0 0 0 0 0 5.2340 -5.4230 -3.1870 H 0 0 0 0 0 0 0 0 0 0 0 0 3.0600 -3.6000 -5.6480 H 0 0 0 0 0 0 0 0 0 0 0 0 5.7110 -10.3520 -5.1860 N 0 3 0 0 0 0 0 0 0 0 0 0 4.9620 -11.0420 -5.0290 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 30 1 0 0 0 0 1 31 1 0 0 0 0 1 32 1 0 0 0 0 2 3 1 0 0 0 0 2 33 1 0 0 0 0 2 34 1 0 0 0 0 3 4 1 0 0 0 0 4 5 1 0 0 0 0 4 9 2 0 0 0 0 5 6 2 0 0 0 0 5 35 1 0 0 0 0 6 7 1 0 0 0 0 6 36 1 0 0 0 0 7 8 2 0 0 0 0 7 37 1 0 0 0 0 8 9 1 0 0 0 0 8 10 1 0 0 0 0 9 38 1 0 0 0 0 10 11 2 0 0 0 0 10 29 1 0 0 0 0 11 12 1 0 0 0 0 11 17 1 0 0 0 0 12 13 1 0 0 0 0 12 14 1 0 0 0 0 12 23 1 0 0 0 0 14 15 1 0 0 0 0 14 19 1 0 0 0 0 15 16 2 0 0 0 0 15 17 1 0 0 0 0 17 18 2 0 0 0 0 19 20 1 0 0 0 0 19 39 1 0 0 0 0 19 40 1 0 0 0 0 20 41 1 0 0 0 0 20 42 1 0 0 0 0 20 54 1 0 0 0 0 21 43 1 0 0 0 0 21 44 1 0 0 0 0 21 45 1 0 0 0 0 21 54 1 0 0 0 0 22 46 1 0 0 0 0 22 47 1 0 0 0 0 22 48 1 0 0 0 0 22 54 1 0 0 0 0 23 24 1 0 0 0 0 23 28 2 0 0 0 0 24 25 2 0 0 0 0 24 49 1 0 0 0 0 25 26 1 0 0 0 0 25 50 1 0 0 0 0 26 27 2 0 0 0 0 27 28 1 0 0 0 0 27 51 1 0 0 0 0 28 52 1 0 0 0 0 29 53 1 0 0 0 0 54 55 1 0 0 0 0 M CHG 1 54 1 M END