PUBCHEM-ZINC00000574 MOE2007 3D CORINA 3.40 0006 02.08.2006 44 47 0 0 1 0 0 0 0 0999 V2000 -0.2440 1.2950 -0.4190 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.2900 -0.1190 -0.2860 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.5270 -0.7060 -0.2850 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.7440 -0.0410 -0.3850 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.9550 -0.7480 -0.3790 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.9330 -2.1540 -0.2880 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.7180 -2.8320 -0.1330 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.5110 -2.0990 -0.1530 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.0210 -4.2040 0.0440 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.3940 -4.3350 0.0280 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.9620 -3.1090 -0.2940 N 0 0 0 0 0 0 0 0 0 0 0 0 -6.3310 -2.8810 -0.5780 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.1530 -3.6930 -0.1630 O 0 0 0 0 0 0 0 0 0 0 0 0 -6.8550 -1.7550 -1.3750 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.9710 -1.0550 -0.9100 C 0 0 0 0 0 0 0 0 0 0 0 0 -8.4870 -0.0010 -1.6650 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.9000 0.3370 -2.8850 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.8010 -0.3810 -3.3600 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.2800 -1.4360 -2.6100 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.1240 -5.6300 0.1970 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.1800 -6.7310 0.7170 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.8000 -6.7070 0.0280 C 0 0 3 0 0 0 0 0 0 0 0 0 -2.9540 -6.8390 -1.0520 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.0930 -5.3560 0.2640 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.9100 -7.8800 0.4840 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.6800 -7.6160 0.6080 O 0 0 0 0 0 0 0 0 0 0 0 0 0.8080 1.5980 -0.4120 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.6760 1.6170 -1.3720 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.7370 1.7870 0.4260 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.7970 1.0400 -0.4660 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.8850 -0.1910 -0.4330 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5630 -2.6190 -0.0460 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.4420 -1.3220 0.0330 H 0 0 0 0 0 0 0 0 0 0 0 0 -9.3510 0.5530 -1.3070 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.3050 1.1570 -3.4730 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.3560 -0.1230 -4.3170 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.4340 -1.9990 -2.9980 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.9520 -5.5280 0.9060 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.5380 -5.9370 -0.7710 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.0400 -6.6050 1.7990 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.6740 -7.7010 0.5830 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.2320 -5.2650 -0.4090 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.7100 -5.2980 1.2920 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.5030 -8.9830 0.6520 O 0 5 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 27 1 0 0 0 0 1 28 1 0 0 0 0 1 29 1 0 0 0 0 2 3 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 30 1 0 0 0 0 5 6 1 0 0 0 0 5 31 1 0 0 0 0 6 7 2 0 0 0 0 6 11 1 0 0 0 0 7 8 1 0 0 0 0 7 9 1 0 0 0 0 8 32 1 0 0 0 0 9 10 2 0 0 0 0 9 24 1 0 0 0 0 10 11 1 0 0 0 0 10 20 1 0 0 0 0 11 12 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 2 0 0 0 0 15 16 2 0 0 0 0 15 33 1 0 0 0 0 16 17 1 0 0 0 0 16 34 1 0 0 0 0 17 18 2 0 0 0 0 17 35 1 0 0 0 0 18 19 1 0 0 0 0 18 36 1 0 0 0 0 19 37 1 0 0 0 0 20 21 1 0 0 0 0 20 38 1 0 0 0 0 20 39 1 0 0 0 0 21 22 1 0 0 0 0 21 40 1 0 0 0 0 21 41 1 0 0 0 0 22 23 1 0 0 0 0 22 24 1 0 0 0 0 22 25 1 0 0 0 0 24 42 1 0 0 0 0 24 43 1 0 0 0 0 25 26 2 0 0 0 0 25 44 1 0 0 0 0 M CHG 1 44 -1 M END