PUBCHEM-ZINC03678547 MOE2007 3D CORINA 3.40 0006 02.08.2006 52 55 0 0 1 0 0 0 0 0999 V2000 -3.0480 4.0300 -0.1060 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.1460 2.8160 0.0600 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.9320 1.5290 0.0520 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.1130 0.8160 -1.1360 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.8380 -0.3780 -1.1460 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.4120 -0.8650 0.0310 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.2790 -0.1380 1.2330 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.5120 1.0430 1.2300 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.8930 -0.6920 2.5090 C 0 0 3 0 0 0 0 0 0 0 0 0 -5.8230 -1.2230 2.2720 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.2440 0.3200 3.5540 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.9100 0.2680 4.8920 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.4710 1.4100 5.5250 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.4660 1.9090 6.8430 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.1470 3.0980 7.1310 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.8280 3.7860 6.1290 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.8490 3.3100 4.8140 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.1630 2.1210 4.5410 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.0240 1.4300 3.3560 N 0 0 0 0 0 0 0 0 0 0 0 0 -6.4410 1.7170 2.4790 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.1030 -0.8500 5.4580 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.2060 -2.1060 4.5680 C 0 0 3 0 0 0 0 0 0 0 0 0 -3.4020 -2.8080 4.8170 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.5210 -2.8660 4.7280 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.1880 -3.2530 3.7760 O 0 0 0 0 0 0 0 0 0 0 0 0 -5.7970 -3.1040 6.0370 O 0 0 0 0 0 0 0 0 0 0 0 0 -7.0050 -3.8350 6.2660 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.0900 -2.0530 0.1350 O 0 0 0 0 0 0 0 0 0 0 0 0 -5.3690 -2.7540 -1.0740 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.4520 4.9480 -0.1000 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.5990 3.9880 -1.0510 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.7800 4.0950 0.7070 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.3980 2.8000 -0.7420 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.5830 2.8960 0.9980 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.6780 1.1800 -2.0660 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.9250 -0.9060 -2.0900 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.3570 1.6060 2.1510 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.9400 1.3810 7.6340 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.1450 3.4860 8.1470 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.3520 4.7080 6.3720 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.3830 3.8510 4.0390 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.0540 -0.5280 5.5050 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.4180 -1.0640 6.4850 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.9370 -4.8320 5.8200 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.1350 -3.9450 7.3460 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.8650 -3.2880 5.8660 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.9520 -2.1360 -1.7650 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.4460 -3.1110 -1.5410 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.9730 -3.6290 -0.8180 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.9550 -1.7260 3.1030 N 0 3 0 0 0 0 0 0 0 0 0 0 -4.0480 -2.5640 2.5090 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.9930 -1.3850 2.9930 H 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 3 1 0 0 0 0 2 33 1 0 0 0 0 2 34 1 0 0 0 0 3 4 1 0 0 0 0 3 8 2 0 0 0 0 4 5 2 0 0 0 0 4 35 1 0 0 0 0 5 6 1 0 0 0 0 5 36 1 0 0 0 0 6 7 2 0 0 0 0 6 28 1 0 0 0 0 7 8 1 0 0 0 0 7 9 1 0 0 0 0 8 37 1 0 0 0 0 9 10 1 0 0 0 0 9 11 1 0 0 0 0 9 50 1 0 0 0 0 11 12 2 0 0 0 0 11 19 1 0 0 0 0 12 13 1 0 0 0 0 12 21 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 38 1 0 0 0 0 15 16 1 0 0 0 0 15 39 1 0 0 0 0 16 17 2 0 0 0 0 16 40 1 0 0 0 0 17 18 1 0 0 0 0 17 41 1 0 0 0 0 18 19 1 0 0 0 0 19 20 1 0 0 0 0 21 22 1 0 0 0 0 21 42 1 0 0 0 0 21 43 1 0 0 0 0 22 23 1 0 0 0 0 22 24 1 0 0 0 0 22 50 1 0 0 0 0 24 25 2 0 0 0 0 24 26 1 0 0 0 0 26 27 1 0 0 0 0 27 44 1 0 0 0 0 27 45 1 0 0 0 0 27 46 1 0 0 0 0 28 29 1 0 0 0 0 29 47 1 0 0 0 0 29 48 1 0 0 0 0 29 49 1 0 0 0 0 50 51 1 0 0 0 0 50 52 1 0 0 0 0 M CHG 1 50 1 M END