PUBCHEM-ZINC00445126 MOE2007 3D CORINA 3.40 0006 02.08.2006 38 39 0 0 0 0 0 0 0 0999 V2000 -0.0180 1.4610 0.0100 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0020 -0.0040 0.0020 N 0 0 0 0 0 0 0 0 0 0 0 0 0.0240 -0.7430 1.2670 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.3890 -1.0160 1.7140 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.0290 -2.1750 1.3140 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.3250 -2.4250 1.7250 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.9810 -1.5170 2.5340 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.3410 -0.3590 2.9340 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.0430 -0.1100 2.5280 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0000 -0.6720 -1.1690 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0170 -1.8880 -1.1760 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.0220 0.0670 -2.4330 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0240 -0.6000 -3.6040 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0460 0.1420 -4.8750 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0480 -0.5470 -6.0920 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0690 0.1560 -7.2780 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0870 1.5400 -7.2660 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0850 2.2290 -6.0660 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0710 1.5400 -4.8710 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.1080 2.2870 -8.5440 N 0 3 0 0 0 0 0 0 0 0 0 0 -0.1100 1.6840 -9.6020 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.1250 3.5050 -8.5370 O 0 5 0 0 0 0 0 0 0 0 0 0 1.0050 1.8380 0.0020 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5450 1.8220 -0.8730 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5280 1.8120 0.9070 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5500 -1.6880 1.1260 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5370 -0.1510 2.0250 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.5160 -2.8840 0.6820 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.8250 -3.3300 1.4120 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.9940 -1.7120 2.8540 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.8540 0.3510 3.5660 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.5420 0.7930 2.8430 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0370 1.1470 -2.4270 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0090 -1.6800 -3.6100 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0330 -1.6260 -6.1020 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0710 -0.3740 -8.2180 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0990 3.3090 -6.0640 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0740 2.0800 -3.9350 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 23 1 0 0 0 0 1 24 1 0 0 0 0 1 25 1 0 0 0 0 2 3 1 0 0 0 0 2 10 1 0 0 0 0 3 4 1 0 0 0 0 3 26 1 0 0 0 0 3 27 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 28 1 0 0 0 0 6 7 1 0 0 0 0 6 29 1 0 0 0 0 7 8 2 0 0 0 0 7 30 1 0 0 0 0 8 9 1 0 0 0 0 8 31 1 0 0 0 0 9 32 1 0 0 0 0 10 11 2 0 0 0 0 10 12 1 0 0 0 0 12 13 2 0 0 0 0 12 33 1 0 0 0 0 13 14 1 0 0 0 0 13 34 1 0 0 0 0 14 15 1 0 0 0 0 14 19 2 0 0 0 0 15 16 2 0 0 0 0 15 35 1 0 0 0 0 16 17 1 0 0 0 0 16 36 1 0 0 0 0 17 18 2 0 0 0 0 17 20 1 0 0 0 0 18 19 1 0 0 0 0 18 37 1 0 0 0 0 19 38 1 0 0 0 0 20 21 2 0 0 0 0 20 22 1 0 0 0 0 M CHG 1 20 1 M CHG 1 22 -1 M END