PUBCHEM-ZINC04165592 MOE2007 3D CORINA 3.40 0006 02.08.2006 56 60 0 0 0 0 0 0 0 0999 V2000 0.0540 1.9910 -0.4660 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2810 2.6080 -0.2340 C 0 0 0 0 0 0 0 0 0 0 0 0 2.4430 1.8370 -0.1230 C 0 0 0 0 0 0 0 0 0 0 0 0 2.4000 0.4370 -0.2420 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1510 -0.1630 -0.4770 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0120 0.6060 -0.5880 C 0 0 0 0 0 0 0 0 0 0 0 0 3.6260 -0.3750 -0.1250 C 0 0 0 0 0 0 0 0 0 0 0 0 3.9730 -1.3100 -1.1180 C 0 0 0 0 0 0 0 0 0 0 0 0 5.1370 -2.0800 -1.0130 C 0 0 0 0 0 0 0 0 0 0 0 0 5.9630 -1.9340 0.1030 C 0 0 0 0 0 0 0 0 0 0 0 0 5.6540 -0.9980 1.0900 C 0 0 0 0 0 0 0 0 0 0 0 0 4.4890 -0.2300 0.9770 C 0 0 0 0 0 0 0 0 0 0 0 0 7.2190 -2.7020 0.2120 C 0 0 0 0 0 0 0 0 0 0 0 0 8.2610 -2.0600 0.3160 O 0 0 0 0 0 0 0 0 0 0 0 0 7.1730 -4.0970 0.1910 N 0 0 0 0 0 0 0 0 0 0 0 0 8.4250 -4.8410 0.0440 C 0 0 0 0 0 0 0 0 0 0 0 0 8.5970 -5.8900 1.1440 C 0 0 0 0 0 0 0 0 0 0 0 0 6.1050 -5.9960 1.3960 C 0 0 0 0 0 0 0 0 0 0 0 0 5.9600 -4.9180 0.3090 C 0 0 0 0 0 0 0 0 0 0 0 0 7.5480 -7.9220 2.1880 C 0 0 0 0 0 0 0 0 0 0 0 0 6.5590 -9.0210 2.0050 C 0 0 0 0 0 0 0 0 0 0 0 0 5.4830 -9.3050 2.8250 C 0 0 0 0 0 0 0 0 0 0 0 0 4.8130 -10.3800 2.3030 N 0 0 0 0 0 0 0 0 0 0 0 0 3.9880 -10.8080 2.7030 H 0 0 0 0 0 0 0 0 0 0 0 0 5.4250 -10.8020 1.1460 C 0 0 0 0 0 0 0 0 0 0 0 0 6.5370 -9.9830 0.9420 C 0 0 0 0 0 0 0 0 0 0 0 0 7.3590 -10.2330 -0.1790 C 0 0 0 0 0 0 0 0 0 0 0 0 7.0300 -11.2740 -1.0550 C 0 0 0 0 0 0 0 0 0 0 0 0 5.9050 -12.0620 -0.8300 C 0 0 0 0 0 0 0 0 0 0 0 0 5.0820 -11.8430 0.2770 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.8490 2.5900 -0.5520 H 0 0 0 0 0 0 0 0 0 0 0 0 1.3370 3.6890 -0.1420 H 0 0 0 0 0 0 0 0 0 0 0 0 3.3890 2.3480 0.0460 H 0 0 0 0 0 0 0 0 0 0 0 0 1.0690 -1.2450 -0.5660 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9690 0.1220 -0.7670 H 0 0 0 0 0 0 0 0 0 0 0 0 3.3450 -1.4270 -1.9990 H 0 0 0 0 0 0 0 0 0 0 0 0 5.3950 -2.7720 -1.8100 H 0 0 0 0 0 0 0 0 0 0 0 0 6.3130 -0.8560 1.9430 H 0 0 0 0 0 0 0 0 0 0 0 0 4.2570 0.4880 1.7620 H 0 0 0 0 0 0 0 0 0 0 0 0 8.3920 -5.3280 -0.9380 H 0 0 0 0 0 0 0 0 0 0 0 0 9.2890 -4.1680 0.0410 H 0 0 0 0 0 0 0 0 0 0 0 0 9.4720 -6.5170 0.9450 H 0 0 0 0 0 0 0 0 0 0 0 0 8.6840 -5.4290 2.1340 H 0 0 0 0 0 0 0 0 0 0 0 0 6.1760 -5.5460 2.3920 H 0 0 0 0 0 0 0 0 0 0 0 0 5.2560 -6.6840 1.3570 H 0 0 0 0 0 0 0 0 0 0 0 0 5.0870 -4.3070 0.5460 H 0 0 0 0 0 0 0 0 0 0 0 0 5.7920 -5.3870 -0.6680 H 0 0 0 0 0 0 0 0 0 0 0 0 7.4840 -7.4740 3.1850 H 0 0 0 0 0 0 0 0 0 0 0 0 8.5610 -8.3210 2.0560 H 0 0 0 0 0 0 0 0 0 0 0 0 5.1340 -8.8380 3.7370 H 0 0 0 0 0 0 0 0 0 0 0 0 8.2470 -9.6380 -0.3700 H 0 0 0 0 0 0 0 0 0 0 0 0 7.6610 -11.4730 -1.9180 H 0 0 0 0 0 0 0 0 0 0 0 0 5.6650 -12.8660 -1.5230 H 0 0 0 0 0 0 0 0 0 0 0 0 4.2100 -12.4660 0.4530 H 0 0 0 0 0 0 0 0 0 0 0 0 7.3790 -6.8020 1.1790 N 0 3 0 0 0 0 0 0 0 0 0 0 7.2990 -7.2580 0.2610 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 31 1 0 0 0 0 2 3 2 0 0 0 0 2 32 1 0 0 0 0 3 4 1 0 0 0 0 3 33 1 0 0 0 0 4 5 2 0 0 0 0 4 7 1 0 0 0 0 5 6 1 0 0 0 0 5 34 1 0 0 0 0 6 35 1 0 0 0 0 7 8 1 0 0 0 0 7 12 2 0 0 0 0 8 9 2 0 0 0 0 8 36 1 0 0 0 0 9 10 1 0 0 0 0 9 37 1 0 0 0 0 10 11 2 0 0 0 0 10 13 1 0 0 0 0 11 12 1 0 0 0 0 11 38 1 0 0 0 0 12 39 1 0 0 0 0 13 14 2 0 0 0 0 13 15 1 0 0 0 0 15 16 1 0 0 0 0 15 19 1 0 0 0 0 16 17 1 0 0 0 0 16 40 1 0 0 0 0 16 41 1 0 0 0 0 17 42 1 0 0 0 0 17 43 1 0 0 0 0 17 55 1 0 0 0 0 18 19 1 0 0 0 0 18 44 1 0 0 0 0 18 45 1 0 0 0 0 18 55 1 0 0 0 0 19 46 1 0 0 0 0 19 47 1 0 0 0 0 20 21 1 0 0 0 0 20 48 1 0 0 0 0 20 49 1 0 0 0 0 20 55 1 0 0 0 0 21 22 2 0 0 0 0 21 26 1 0 0 0 0 22 23 1 0 0 0 0 22 50 1 0 0 0 0 23 24 1 0 0 0 0 23 25 1 0 0 0 0 25 26 1 0 0 0 0 25 30 2 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 29 2 0 0 0 0 28 52 1 0 0 0 0 29 30 1 0 0 0 0 29 53 1 0 0 0 0 30 54 1 0 0 0 0 55 56 1 0 0 0 0 M CHG 1 55 1 M END