PUBCHEM-ZINC03609743 MOE2007 3D CORINA 3.40 0006 02.08.2006 42 42 0 0 1 0 0 0 0 0999 V2000 -0.0380 1.5900 0.1840 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.3100 0.0950 0.0790 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.7350 -0.2340 0.5110 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0420 -0.8270 0.4940 C 0 0 0 0 0 0 0 0 0 0 0 0 2.8620 -1.2460 1.7150 C 0 0 3 0 0 0 0 0 0 0 0 0 2.6340 -2.2810 1.9940 H 0 0 0 0 0 0 0 0 0 0 0 0 4.3650 -1.0700 1.4970 C 0 0 0 0 0 0 0 0 0 0 0 0 5.0120 -1.5410 2.6830 O 0 0 0 0 0 0 0 0 0 0 0 0 6.3800 -1.5630 2.6850 C 0 0 0 0 0 0 0 0 0 0 0 0 6.9550 -2.1380 3.8220 C 0 0 0 0 0 0 0 0 0 0 0 0 8.3440 -2.2270 3.9520 C 0 0 0 0 0 0 0 0 0 0 0 0 9.1740 -1.7450 2.9370 C 0 0 0 0 0 0 0 0 0 0 0 0 8.6050 -1.1480 1.8080 C 0 0 0 0 0 0 0 0 0 0 0 0 7.2110 -1.0600 1.6820 C 0 0 0 0 0 0 0 0 0 0 0 0 10.6430 -1.8610 3.1130 C 0 0 0 0 0 0 0 0 0 0 0 0 11.1220 -1.8550 4.2430 O 0 0 0 0 0 0 0 0 0 0 0 0 11.3920 -2.0030 1.9610 N 0 0 0 0 0 0 0 0 0 0 0 0 12.8300 -2.0830 2.0170 C 0 0 0 0 0 0 0 0 0 0 0 0 2.4120 -0.4210 2.8100 O 0 0 0 0 0 0 0 0 0 0 0 0 3.0670 -0.5530 3.5290 H 0 0 0 0 0 0 0 0 0 0 0 0 0.9650 1.8460 -0.1690 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.7510 2.1530 -0.4290 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.1330 1.9440 1.2170 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.1410 -0.2650 -0.9410 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.4600 0.2880 -0.1220 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.9330 -1.3080 0.4270 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.9180 0.0630 1.5500 H 0 0 0 0 0 0 0 0 0 0 0 0 2.3750 0.1430 0.1150 H 0 0 0 0 0 0 0 0 0 0 0 0 2.0500 -1.5730 -0.3060 H 0 0 0 0 0 0 0 0 0 0 0 0 4.6840 -1.6570 0.6280 H 0 0 0 0 0 0 0 0 0 0 0 0 4.5990 -0.0080 1.3570 H 0 0 0 0 0 0 0 0 0 0 0 0 6.3200 -2.5240 4.6160 H 0 0 0 0 0 0 0 0 0 0 0 0 8.7710 -2.6790 4.8460 H 0 0 0 0 0 0 0 0 0 0 0 0 9.2230 -0.7180 1.0240 H 0 0 0 0 0 0 0 0 0 0 0 0 6.8130 -0.5830 0.7920 H 0 0 0 0 0 0 0 0 0 0 0 0 10.9450 -2.0740 1.0560 H 0 0 0 0 0 0 0 0 0 0 0 0 13.1150 -3.0370 2.4680 H 0 0 0 0 0 0 0 0 0 0 0 0 13.2250 -2.0200 1.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 13.2220 -1.2620 2.6230 H 0 0 0 0 0 0 0 0 0 0 0 0 0.6270 -0.6560 0.9730 N 0 3 0 0 0 0 0 0 0 0 0 0 0.7260 -0.1930 1.9010 H 0 0 0 0 0 0 0 0 0 0 0 0 0.2420 -1.5840 1.1930 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 21 1 0 0 0 0 1 22 1 0 0 0 0 1 23 1 0 0 0 0 2 3 1 0 0 0 0 2 24 1 0 0 0 0 2 40 1 0 0 0 0 3 25 1 0 0 0 0 3 26 1 0 0 0 0 3 27 1 0 0 0 0 4 5 1 0 0 0 0 4 28 1 0 0 0 0 4 29 1 0 0 0 0 4 40 1 0 0 0 0 5 6 1 0 0 0 0 5 7 1 0 0 0 0 5 19 1 0 0 0 0 7 8 1 0 0 0 0 7 30 1 0 0 0 0 7 31 1 0 0 0 0 8 9 1 0 0 0 0 9 10 1 0 0 0 0 9 14 2 0 0 0 0 10 11 2 0 0 0 0 10 32 1 0 0 0 0 11 12 1 0 0 0 0 11 33 1 0 0 0 0 12 13 2 0 0 0 0 12 15 1 0 0 0 0 13 14 1 0 0 0 0 13 34 1 0 0 0 0 14 35 1 0 0 0 0 15 16 2 0 0 0 0 15 17 1 0 0 0 0 17 18 1 0 0 0 0 17 36 1 0 0 0 0 18 37 1 0 0 0 0 18 38 1 0 0 0 0 18 39 1 0 0 0 0 19 20 1 0 0 0 0 40 41 1 0 0 0 0 40 42 1 0 0 0 0 M CHG 1 40 1 M END