PUBCHEM-ZINC06778677 MOE2007 3D CORINA 3.40 0006 02.08.2006 49 51 0 0 1 0 0 0 0 0999 V2000 0.9870 1.9670 1.3010 C 0 0 0 0 0 0 0 0 0 0 0 0 0.7450 0.4740 1.0700 C 0 0 0 0 0 0 0 0 0 0 0 0 1.5180 -0.3350 2.1130 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2760 -1.8280 1.8820 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0500 -2.6370 2.9250 C 0 0 3 0 0 0 0 0 0 0 0 0 1.7720 -2.3010 3.9250 H 0 0 0 0 0 0 0 0 0 0 0 0 1.7150 -4.0990 2.7760 C 0 0 0 0 0 0 0 0 0 0 0 0 0.9480 -4.7600 3.5690 N 0 0 0 0 0 0 0 0 0 0 0 0 0.7730 -6.0490 3.2680 C 0 0 0 0 0 0 0 0 0 0 0 0 1.4440 -6.4450 2.1630 C 0 0 0 0 0 0 0 0 0 0 0 0 2.2960 -5.1070 1.5260 S 0 0 0 0 0 0 0 0 0 0 0 0 -0.0710 -6.9560 4.0650 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0740 -8.1480 3.8280 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.8380 -6.4630 5.0570 N 0 0 0 0 0 0 0 0 0 0 0 0 -0.9820 -5.0120 5.2510 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.4750 -4.6770 5.3300 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.1060 -5.5070 6.3650 N 0 0 0 0 0 0 0 0 0 0 0 0 -3.0260 -6.9340 6.0250 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.5600 -7.3620 5.9710 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.4180 -5.1210 6.5790 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.1420 -5.7650 7.4830 N 0 0 0 0 0 0 0 0 0 0 0 0 -6.3980 -5.4210 7.7120 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.9550 -4.3750 6.9940 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.1690 -3.7230 6.0560 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.9180 -4.1140 5.8800 N 0 0 0 0 0 0 0 0 0 0 0 0 2.0520 2.1810 1.2100 H 0 0 0 0 0 0 0 0 0 0 0 0 0.4360 2.5440 0.5580 H 0 0 0 0 0 0 0 0 0 0 0 0 0.6460 2.2410 2.3000 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.3200 0.2610 1.1610 H 0 0 0 0 0 0 0 0 0 0 0 0 1.0860 0.2010 0.0720 H 0 0 0 0 0 0 0 0 0 0 0 0 2.5830 -0.1210 2.0220 H 0 0 0 0 0 0 0 0 0 0 0 0 1.1770 -0.0620 3.1120 H 0 0 0 0 0 0 0 0 0 0 0 0 0.2110 -2.0420 1.9730 H 0 0 0 0 0 0 0 0 0 0 0 0 1.6180 -2.1010 0.8840 H 0 0 0 0 0 0 0 0 0 0 0 0 1.4390 -7.4420 1.7480 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.4910 -4.7160 6.1780 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5320 -4.4840 4.4100 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.5990 -3.6240 5.5840 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.9440 -4.8770 4.3670 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.5480 -7.5180 6.7830 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.4870 -7.1030 5.0520 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.4920 -8.3860 5.6050 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.1250 -7.2960 6.9680 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.9840 -5.9500 8.4500 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.9790 -4.0740 7.1600 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.5730 -2.9040 5.4790 H 0 0 0 0 0 0 0 0 0 0 0 0 3.7740 -2.7460 1.8060 H 0 0 0 0 0 0 0 0 0 0 0 0 3.4920 -2.4420 2.7260 N 0 0 0 0 0 0 0 0 0 0 0 0 3.7520 -1.4800 2.8840 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 26 1 0 0 0 0 1 27 1 0 0 0 0 1 28 1 0 0 0 0 2 3 1 0 0 0 0 2 29 1 0 0 0 0 2 30 1 0 0 0 0 3 4 1 0 0 0 0 3 31 1 0 0 0 0 3 32 1 0 0 0 0 4 5 1 0 0 0 0 4 33 1 0 0 0 0 4 34 1 0 0 0 0 5 6 1 0 0 0 0 5 7 1 0 0 0 0 5 48 1 0 0 0 0 7 8 2 0 0 0 0 7 11 1 0 0 0 0 8 9 1 0 0 0 0 9 10 2 0 0 0 0 9 12 1 0 0 0 0 10 11 1 0 0 0 0 10 35 1 0 0 0 0 12 13 2 0 0 0 0 12 14 1 0 0 0 0 14 15 1 0 0 0 0 14 19 1 0 0 0 0 15 16 1 0 0 0 0 15 36 1 0 0 0 0 15 37 1 0 0 0 0 16 17 1 0 0 0 0 16 38 1 0 0 0 0 16 39 1 0 0 0 0 17 18 1 0 0 0 0 17 20 1 0 0 0 0 18 19 1 0 0 0 0 18 40 1 0 0 0 0 18 41 1 0 0 0 0 19 42 1 0 0 0 0 19 43 1 0 0 0 0 20 21 1 0 0 0 0 20 25 2 0 0 0 0 21 22 2 0 0 0 0 22 23 1 0 0 0 0 22 44 1 0 0 0 0 23 24 2 0 0 0 0 23 45 1 0 0 0 0 24 25 1 0 0 0 0 24 46 1 0 0 0 0 47 48 1 0 0 0 0 48 49 1 0 0 0 0 M END