PUBCHEM-ZINC06130594 MOE2007 3D CORINA 3.40 0006 02.08.2006 42 44 0 0 1 0 0 0 0 0999 V2000 -0.0180 1.5030 0.0100 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0020 -0.0040 0.0020 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0230 -0.7010 1.1950 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0410 -2.0880 1.1870 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0390 -2.7730 -0.0200 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0180 -2.0730 -1.2100 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0060 -0.6890 -1.2000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0390 0.1890 -2.6980 Cl 0 0 0 0 0 0 0 0 0 0 0 0 0.0620 -2.7750 2.3590 O 0 0 0 0 0 0 0 0 0 0 0 0 0.0800 -4.2010 2.2750 C 0 0 0 0 0 0 0 0 0 0 0 0 0.1020 -4.7860 3.6640 C 0 0 0 0 0 0 0 0 0 0 0 0 0.1020 -4.0570 4.6260 O 0 0 0 0 0 0 0 0 0 0 0 0 0.1240 -6.2810 3.8510 C 0 0 3 0 0 0 0 0 0 0 0 0 -0.3920 -6.7600 3.0190 H 0 0 0 0 0 0 0 0 0 0 0 0 1.5180 -6.7500 3.8980 C 0 0 0 0 0 0 0 0 0 0 0 0 2.5950 -7.1110 3.9350 N 0 0 0 0 0 0 0 0 0 0 0 0 -0.5690 -6.6360 5.1420 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.5340 -5.8870 6.2770 N 0 0 0 0 0 0 0 0 0 0 0 0 -0.0660 -5.0450 6.3960 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.2870 -6.5460 7.2280 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.6180 -6.2840 8.5500 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.4140 -7.1710 9.2430 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.8860 -8.3220 8.6270 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.5700 -8.5960 7.3260 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.7650 -7.7110 6.6040 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.2930 -7.7000 5.3310 N 0 3 0 0 0 0 0 0 0 0 0 0 -1.5560 -8.7320 4.3250 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0040 1.8800 0.0030 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5460 1.8640 -0.8730 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5290 1.8540 0.9070 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0250 -0.1660 2.1330 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0530 -3.8520 -0.0280 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0160 -2.6050 -2.1500 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.8110 -4.5460 1.7500 H 0 0 0 0 0 0 0 0 0 0 0 0 0.9690 -4.5220 1.7320 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.2530 -5.3900 9.0340 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.6720 -6.9700 10.2720 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.5090 -9.0080 9.1810 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.9420 -9.4940 6.8570 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.7860 -9.5010 4.3830 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.5320 -9.1800 4.5110 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.5460 -8.2820 3.3320 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 28 1 0 0 0 0 1 29 1 0 0 0 0 1 30 1 0 0 0 0 2 3 1 0 0 0 0 2 7 2 0 0 0 0 3 4 2 0 0 0 0 3 31 1 0 0 0 0 4 5 1 0 0 0 0 4 9 1 0 0 0 0 5 6 2 0 0 0 0 5 32 1 0 0 0 0 6 7 1 0 0 0 0 6 33 1 0 0 0 0 7 8 1 0 0 0 0 9 10 1 0 0 0 0 10 11 1 0 0 0 0 10 34 1 0 0 0 0 10 35 1 0 0 0 0 11 12 2 0 0 0 0 11 13 1 0 0 0 0 13 14 1 0 0 0 0 13 15 1 0 0 0 0 13 17 1 0 0 0 0 15 16 3 0 0 0 0 17 18 1 0 0 0 0 17 26 2 0 0 0 0 18 19 1 0 0 0 0 18 20 1 0 0 0 0 20 21 1 0 0 0 0 20 25 2 0 0 0 0 21 22 2 0 0 0 0 21 36 1 0 0 0 0 22 23 1 0 0 0 0 22 37 1 0 0 0 0 23 24 2 0 0 0 0 23 38 1 0 0 0 0 24 25 1 0 0 0 0 24 39 1 0 0 0 0 25 26 1 0 0 0 0 26 27 1 0 0 0 0 27 40 1 0 0 0 0 27 41 1 0 0 0 0 27 42 1 0 0 0 0 M CHG 1 26 1 M END