PUBCHEM-ZINC01197143 MOE2007 3D CORINA 3.40 0006 02.08.2006 51 54 0 0 1 0 0 0 0 0999 V2000 0.9040 1.3720 1.3600 C 0 0 0 0 0 0 0 0 0 0 0 0 0.9370 -0.0100 1.3680 C 0 0 0 0 0 0 0 0 0 0 0 0 2.1050 -0.6750 1.0460 C 0 0 0 0 0 0 0 0 0 0 0 0 3.2400 0.0420 0.7150 C 0 0 0 0 0 0 0 0 0 0 0 0 3.2060 1.4240 0.7060 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0380 2.0890 1.0290 C 0 0 0 0 0 0 0 0 0 0 0 0 4.5140 -0.6830 0.3650 C 0 0 0 0 0 0 0 0 0 0 0 0 4.5510 -0.9440 -1.1190 C 0 0 0 0 0 0 0 0 0 0 0 0 3.6340 -0.5780 -1.8230 O 0 0 0 0 0 0 0 0 0 0 0 0 5.6040 -1.5850 -1.6640 N 0 0 0 0 0 0 0 0 0 0 0 0 5.6410 -1.8390 -3.1060 C 0 0 3 0 0 0 0 0 0 0 0 0 4.6320 -2.0410 -3.4650 H 0 0 0 0 0 0 0 0 0 0 0 0 6.5210 -3.0310 -3.3840 C 0 0 0 0 0 0 0 0 0 0 0 0 6.2100 -3.8930 -4.4190 C 0 0 0 0 0 0 0 0 0 0 0 0 7.0170 -4.9860 -4.6740 C 0 0 0 0 0 0 0 0 0 0 0 0 8.1340 -5.2170 -3.8940 C 0 0 0 0 0 0 0 0 0 0 0 0 8.4460 -4.3540 -2.8600 C 0 0 0 0 0 0 0 0 0 0 0 0 7.6420 -3.2590 -2.6080 C 0 0 0 0 0 0 0 0 0 0 0 0 8.9980 -6.3880 -4.1670 N 0 3 0 0 0 0 0 0 0 0 0 0 8.7230 -7.1480 -5.0780 O 0 0 0 0 0 0 0 0 0 0 0 0 9.9830 -6.5920 -3.4800 O 0 5 0 0 0 0 0 0 0 0 0 0 6.1950 -0.6300 -3.8150 C 0 0 0 0 0 0 0 0 0 0 0 0 5.5920 -0.1660 -4.9950 C 0 0 0 0 0 0 0 0 0 0 0 0 4.4670 -0.8090 -5.5410 C 0 0 0 0 0 0 0 0 0 0 0 0 3.9080 -0.3310 -6.6860 C 0 0 0 0 0 0 0 0 0 0 0 0 4.4340 0.7880 -7.3290 C 0 0 0 0 0 0 0 0 0 0 0 0 5.5220 1.4370 -6.8290 C 0 0 0 0 0 0 0 0 0 0 0 0 6.1260 0.9740 -5.6480 C 0 0 0 0 0 0 0 0 0 0 0 0 7.2500 1.6190 -5.1030 C 0 0 0 0 0 0 0 0 0 0 0 0 7.8110 1.1450 -3.9590 C 0 0 0 0 0 0 0 0 0 0 0 0 7.2820 0.0240 -3.3100 C 0 0 0 0 0 0 0 0 0 0 0 0 7.8620 -0.4230 -2.1650 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.0100 1.8920 1.6070 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0500 -0.5700 1.6270 H 0 0 0 0 0 0 0 0 0 0 0 0 2.1310 -1.7540 1.0540 H 0 0 0 0 0 0 0 0 0 0 0 0 4.0930 1.9840 0.4470 H 0 0 0 0 0 0 0 0 0 0 0 0 2.0120 3.1690 1.0220 H 0 0 0 0 0 0 0 0 0 0 0 0 5.3700 -0.0710 0.6480 H 0 0 0 0 0 0 0 0 0 0 0 0 4.5510 -1.6310 0.9020 H 0 0 0 0 0 0 0 0 0 0 0 0 6.3380 -1.8790 -1.1010 H 0 0 0 0 0 0 0 0 0 0 0 0 5.3360 -3.7120 -5.0280 H 0 0 0 0 0 0 0 0 0 0 0 0 6.7730 -5.6600 -5.4820 H 0 0 0 0 0 0 0 0 0 0 0 0 9.3190 -4.5350 -2.2500 H 0 0 0 0 0 0 0 0 0 0 0 0 7.8870 -2.5830 -1.8020 H 0 0 0 0 0 0 0 0 0 0 0 0 4.0500 -1.6780 -5.0550 H 0 0 0 0 0 0 0 0 0 0 0 0 3.0450 -0.8280 -7.1040 H 0 0 0 0 0 0 0 0 0 0 0 0 3.9720 1.1470 -8.2360 H 0 0 0 0 0 0 0 0 0 0 0 0 5.9180 2.3030 -7.3380 H 0 0 0 0 0 0 0 0 0 0 0 0 7.6660 2.4880 -5.5910 H 0 0 0 0 0 0 0 0 0 0 0 0 8.6740 1.6420 -3.5430 H 0 0 0 0 0 0 0 0 0 0 0 0 8.6180 -1.0080 -2.3090 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 33 1 0 0 0 0 2 3 2 0 0 0 0 2 34 1 0 0 0 0 3 4 1 0 0 0 0 3 35 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 36 1 0 0 0 0 6 37 1 0 0 0 0 7 8 1 0 0 0 0 7 38 1 0 0 0 0 7 39 1 0 0 0 0 8 9 2 0 0 0 0 8 10 1 0 0 0 0 10 11 1 0 0 0 0 10 40 1 0 0 0 0 11 12 1 0 0 0 0 11 13 1 0 0 0 0 11 22 1 0 0 0 0 13 14 1 0 0 0 0 13 18 2 0 0 0 0 14 15 2 0 0 0 0 14 41 1 0 0 0 0 15 16 1 0 0 0 0 15 42 1 0 0 0 0 16 17 2 0 0 0 0 16 19 1 0 0 0 0 17 18 1 0 0 0 0 17 43 1 0 0 0 0 18 44 1 0 0 0 0 19 20 2 0 0 0 0 19 21 1 0 0 0 0 22 23 1 0 0 0 0 22 31 2 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 45 1 0 0 0 0 25 26 1 0 0 0 0 25 46 1 0 0 0 0 26 27 2 0 0 0 0 26 47 1 0 0 0 0 27 28 1 0 0 0 0 27 48 1 0 0 0 0 28 29 1 0 0 0 0 29 30 2 0 0 0 0 29 49 1 0 0 0 0 30 31 1 0 0 0 0 30 50 1 0 0 0 0 31 32 1 0 0 0 0 32 51 1 0 0 0 0 M CHG 1 19 1 M CHG 1 21 -1 M END