PUBCHEM-ZINC05139348 MOE2007 3D CORINA 3.40 0006 02.08.2006 56 59 0 0 1 0 0 0 0 0999 V2000 -0.8690 -2.2600 -0.9530 C 0 0 0 0 0 0 0 0 0 0 0 0 0.6160 -2.0710 -1.2080 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3100 -0.2010 -1.0860 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3500 0.0700 0.4070 C 0 0 0 0 0 0 0 0 0 0 0 0 0.5920 -0.2200 -2.9460 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0720 1.2240 -2.9040 C 0 0 3 0 0 0 0 0 0 0 0 0 0.9060 1.9250 -2.7880 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.7550 1.5640 -4.1510 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.0540 2.9870 -4.1750 N 0 0 0 0 0 0 0 0 0 0 0 0 -1.9930 3.4770 -5.0800 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.0060 4.8540 -5.4490 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.0670 5.7990 -4.9630 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.1120 7.1520 -5.3530 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.3130 8.2980 -5.0400 C 0 0 0 0 0 0 0 0 0 0 0 0 0.8120 8.5210 -4.2360 C 0 0 0 0 0 0 0 0 0 0 0 0 1.3620 9.7560 -4.1420 N 0 0 0 0 0 0 0 0 0 0 0 0 0.8040 10.7710 -4.8380 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.3070 10.6580 -5.6600 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.8480 9.3770 -5.7370 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.9260 8.9060 -6.4440 N 0 0 0 0 0 0 0 0 0 0 0 0 -2.5040 9.4800 -7.0410 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.1100 7.5540 -6.2330 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.0750 6.6730 -6.7620 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.9990 5.3010 -6.3610 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.8970 4.3470 -6.8620 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.7850 3.0280 -6.4730 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.1380 7.1510 -7.7200 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.7340 1.3240 -1.7090 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.3440 2.0780 -1.8440 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.2040 -1.6460 -0.1100 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.4730 -1.9980 -1.8260 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0750 -3.3060 -0.7080 H 0 0 0 0 0 0 0 0 0 0 0 0 1.1760 -2.3620 -0.3140 H 0 0 0 0 0 0 0 0 0 0 0 0 0.9720 -2.6680 -2.0540 H 0 0 0 0 0 0 0 0 0 0 0 0 2.5640 0.7150 -1.6270 H 0 0 0 0 0 0 0 0 0 0 0 0 3.0040 -0.9930 -1.3850 H 0 0 0 0 0 0 0 0 0 0 0 0 1.6330 0.8500 0.6850 H 0 0 0 0 0 0 0 0 0 0 0 0 2.1240 -0.8240 0.9950 H 0 0 0 0 0 0 0 0 0 0 0 0 3.3480 0.4140 0.6970 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.1930 -0.8960 -3.3000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.4840 -0.3480 -3.5660 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.1980 1.2970 -5.0560 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.6810 0.9770 -4.1180 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.6050 3.6240 -3.5350 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.2710 5.5020 -4.2900 H 0 0 0 0 0 0 0 0 0 0 0 0 1.2930 7.7380 -3.6600 H 0 0 0 0 0 0 0 0 0 0 0 0 1.2980 11.7310 -4.7130 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.7170 11.5020 -6.1980 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.6820 4.6080 -7.5640 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.4640 2.2740 -6.8600 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.0320 6.6470 -8.6860 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.1350 6.9540 -7.3110 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.0740 8.2260 -7.9060 H 0 0 0 0 0 0 0 0 0 0 0 0 0.9180 -0.6200 -1.5050 N 0 3 0 0 0 0 0 0 0 0 0 0 0.2390 -0.0260 -0.9780 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.8580 2.5810 -5.6110 N 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 33 1 0 0 0 0 2 34 1 0 0 0 0 2 54 1 0 0 0 0 3 4 1 0 0 0 0 3 35 1 0 0 0 0 3 36 1 0 0 0 0 3 54 1 0 0 0 0 4 37 1 0 0 0 0 4 38 1 0 0 0 0 4 39 1 0 0 0 0 5 6 1 0 0 0 0 5 40 1 0 0 0 0 5 41 1 0 0 0 0 5 54 1 0 0 0 0 6 7 1 0 0 0 0 6 8 1 0 0 0 0 6 28 1 0 0 0 0 8 9 1 0 0 0 0 8 42 1 0 0 0 0 8 43 1 0 0 0 0 9 10 1 0 0 0 0 9 44 1 0 0 0 0 10 11 1 0 0 0 0 10 56 2 0 0 0 0 11 12 1 0 0 0 0 11 24 2 0 0 0 0 12 13 2 0 0 0 0 12 45 1 0 0 0 0 13 14 1 0 0 0 0 13 22 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 46 1 0 0 0 0 16 17 1 0 0 0 0 17 18 2 0 0 0 0 17 47 1 0 0 0 0 18 19 1 0 0 0 0 18 48 1 0 0 0 0 19 20 1 0 0 0 0 20 21 1 0 0 0 0 20 22 1 0 0 0 0 22 23 2 0 0 0 0 23 24 1 0 0 0 0 23 27 1 0 0 0 0 24 25 1 0 0 0 0 25 26 2 0 0 0 0 25 49 1 0 0 0 0 26 50 1 0 0 0 0 26 56 1 0 0 0 0 27 51 1 0 0 0 0 27 52 1 0 0 0 0 27 53 1 0 0 0 0 28 29 1 0 0 0 0 54 55 1 0 0 0 0 M CHG 1 54 1 M END