PUBCHEM-ZINC04700496 MOE2007 3D CORINA 3.40 0006 02.08.2006 54 55 0 0 1 0 0 0 0 0999 V2000 -0.5880 1.4380 0.0390 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.2710 -0.0350 0.0160 C 0 0 0 0 0 0 0 0 0 0 0 0 0.1000 -0.6890 1.1920 C 0 0 0 0 0 0 0 0 0 0 0 0 0.3920 -2.0540 1.1620 C 0 0 0 0 0 0 0 0 0 0 0 0 0.3100 -2.7470 -0.0280 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0580 -2.0930 -1.1900 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.3530 -0.7410 -1.1660 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.7520 -0.0500 -2.4130 N 0 3 0 0 0 0 0 0 0 0 0 0 -0.9340 -0.6910 -3.4330 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.9000 1.1590 -2.4190 O 0 5 0 0 0 0 0 0 0 0 0 0 0.1860 0.0600 2.4630 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0580 1.2690 2.4660 O 0 0 0 0 0 0 0 0 0 0 0 0 0.4050 -0.5970 3.6190 N 0 0 0 0 0 0 0 0 0 0 0 0 0.4890 0.1460 4.8790 C 0 0 0 0 0 0 0 0 0 0 0 0 0.7420 -0.8300 6.0300 C 0 0 3 0 0 0 0 0 0 0 0 0 -0.0300 -1.5990 6.0300 H 0 0 0 0 0 0 0 0 0 0 0 0 0.7060 -0.0710 7.3590 C 0 0 0 0 0 0 0 0 0 0 0 0 0.8260 -0.9980 8.4400 O 0 0 0 0 0 0 0 0 0 0 0 0 0.8110 -0.4840 9.6980 C 0 0 0 0 0 0 0 0 0 0 0 0 0.9230 -1.3270 10.7940 C 0 0 0 0 0 0 0 0 0 0 0 0 0.9080 -0.8020 12.0720 C 0 0 0 0 0 0 0 0 0 0 0 0 0.7820 0.5630 12.2580 C 0 0 0 0 0 0 0 0 0 0 0 0 0.6700 1.4050 11.1670 C 0 0 0 0 0 0 0 0 0 0 0 0 0.6900 0.8850 9.8880 C 0 0 0 0 0 0 0 0 0 0 0 0 0.7660 1.1330 13.6530 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0750 0.7810 14.3630 C 0 0 0 0 0 0 0 0 0 0 0 0 0.6170 2.6540 13.5810 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.4110 0.5420 14.4320 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0230 -1.4400 5.8650 O 0 0 0 0 0 0 0 0 0 0 0 0 0.3140 2.0070 -0.1880 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.3530 1.6570 -0.7060 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9530 1.7160 1.0270 H 0 0 0 0 0 0 0 0 0 0 0 0 0.6800 -2.5660 2.0680 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5360 -3.8030 -0.0530 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.1190 -2.6400 -2.1190 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5070 -1.5610 3.6170 H 0 0 0 0 0 0 0 0 0 0 0 0 1.3080 0.8630 4.8240 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.4470 0.6770 5.0510 H 0 0 0 0 0 0 0 0 0 0 0 0 1.5330 0.6380 7.3950 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.2380 0.4670 7.4440 H 0 0 0 0 0 0 0 0 0 0 0 0 1.0210 -2.3920 10.6490 H 0 0 0 0 0 0 0 0 0 0 0 0 0.9950 -1.4570 12.9260 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5710 2.4700 11.3160 H 0 0 0 0 0 0 0 0 0 0 0 0 0.6080 1.5440 9.0360 H 0 0 0 0 0 0 0 0 0 0 0 0 2.9140 1.2020 13.8080 H 0 0 0 0 0 0 0 0 0 0 0 0 2.0640 1.1940 15.3720 H 0 0 0 0 0 0 0 0 0 0 0 0 2.1810 -0.3020 14.4140 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.3150 2.9040 13.0750 H 0 0 0 0 0 0 0 0 0 0 0 0 0.6060 3.0660 14.5900 H 0 0 0 0 0 0 0 0 0 0 0 0 1.4560 3.0750 13.0260 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.3050 -0.5420 14.4840 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.4220 0.9540 15.4410 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.3440 0.7920 13.9270 H 0 0 0 0 0 0 0 0 0 0 0 0 2.7590 -0.8130 5.8560 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 7 2 0 0 0 0 3 4 2 0 0 0 0 3 11 1 0 0 0 0 4 5 1 0 0 0 0 4 33 1 0 0 0 0 5 6 2 0 0 0 0 5 34 1 0 0 0 0 6 7 1 0 0 0 0 6 35 1 0 0 0 0 7 8 1 0 0 0 0 8 9 2 0 0 0 0 8 10 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 36 1 0 0 0 0 14 15 1 0 0 0 0 14 37 1 0 0 0 0 14 38 1 0 0 0 0 15 16 1 0 0 0 0 15 17 1 0 0 0 0 15 29 1 0 0 0 0 17 18 1 0 0 0 0 17 39 1 0 0 0 0 17 40 1 0 0 0 0 18 19 1 0 0 0 0 19 20 1 0 0 0 0 19 24 2 0 0 0 0 20 21 2 0 0 0 0 20 41 1 0 0 0 0 21 22 1 0 0 0 0 21 42 1 0 0 0 0 22 23 2 0 0 0 0 22 25 1 0 0 0 0 23 24 1 0 0 0 0 23 43 1 0 0 0 0 24 44 1 0 0 0 0 25 26 1 0 0 0 0 25 27 1 0 0 0 0 25 28 1 0 0 0 0 26 45 1 0 0 0 0 26 46 1 0 0 0 0 26 47 1 0 0 0 0 27 48 1 0 0 0 0 27 49 1 0 0 0 0 27 50 1 0 0 0 0 28 51 1 0 0 0 0 28 52 1 0 0 0 0 28 53 1 0 0 0 0 29 54 1 0 0 0 0 M CHG 1 8 1 M CHG 1 10 -1 M END