CHEMBRIDGE-ZINC04987381 MOE2007 3D CORINA 3.40 0006 02.08.2006 41 42 0 0 0 0 0 0 0 0999 V2000 -0.0410 1.4330 -0.0340 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0450 -0.0790 0.0350 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.2870 -0.6050 -0.0210 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.3710 -1.9630 0.0280 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.3980 -2.7030 0.1230 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.6830 -2.4140 -0.0280 N 0 0 0 0 0 0 0 0 0 0 0 0 -2.9690 -3.8450 0.0160 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.9730 -4.1750 1.1260 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.8680 -1.8290 0.9710 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.8500 -1.5350 -0.1370 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.2550 -3.6670 2.0340 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.6210 -3.1010 1.7470 C 0 0 0 0 0 0 0 0 0 0 0 0 -8.4200 -3.6560 0.7330 C 0 0 0 0 0 0 0 0 0 0 0 0 -9.6720 -3.1130 0.4380 C 0 0 0 0 0 0 0 0 0 0 0 0 -10.1280 -2.0050 1.1600 C 0 0 0 0 0 0 0 0 0 0 0 0 -9.3510 -1.4460 2.1800 C 0 0 0 0 0 0 0 0 0 0 0 0 -8.1010 -1.9970 2.4700 C 0 0 0 0 0 0 0 0 0 0 0 0 -11.4310 -1.4190 0.8390 N 0 3 0 0 0 0 0 0 0 0 0 0 -12.0800 -1.9320 -0.0830 O 0 0 0 0 0 0 0 0 0 0 0 0 -11.8040 -0.4450 1.5070 O 0 5 0 0 0 0 0 0 0 0 0 0 0.9550 1.8840 0.0050 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5370 1.7500 -0.9580 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.6380 1.8230 0.7970 H 0 0 0 0 0 0 0 0 0 0 0 0 0.6270 -0.4560 -0.8140 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5230 -0.3810 0.9740 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.3820 -4.1230 -0.9610 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.0540 -4.4260 0.1640 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.2850 -5.2220 1.0650 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.5550 -3.9680 2.1180 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.4630 -1.5890 1.9610 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.7870 -1.2640 0.7950 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.5680 -0.4800 -0.1000 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.2990 -1.7200 -1.1200 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.8660 -3.3280 3.0010 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.3240 -4.7610 2.0680 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.0810 -4.5220 0.1670 H 0 0 0 0 0 0 0 0 0 0 0 0 -10.2720 -3.5630 -0.3510 H 0 0 0 0 0 0 0 0 0 0 0 0 -9.6970 -0.5880 2.7540 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.5060 -1.5510 3.2660 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.2230 -3.3140 0.9810 N 0 3 0 0 0 0 0 0 0 0 0 0 -5.6420 -3.5340 0.0690 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 25 1 0 0 0 0 3 4 1 0 0 0 0 4 5 2 0 0 0 0 4 6 1 0 0 0 0 6 7 1 0 0 0 0 6 10 1 0 0 0 0 7 8 1 0 0 0 0 7 26 1 0 0 0 0 7 27 1 0 0 0 0 8 28 1 0 0 0 0 8 29 1 0 0 0 0 8 40 1 0 0 0 0 9 10 1 0 0 0 0 9 30 1 0 0 0 0 9 31 1 0 0 0 0 9 40 1 0 0 0 0 10 32 1 0 0 0 0 10 33 1 0 0 0 0 11 12 1 0 0 0 0 11 34 1 0 0 0 0 11 35 1 0 0 0 0 11 40 1 0 0 0 0 12 13 1 0 0 0 0 12 17 2 0 0 0 0 13 14 2 0 0 0 0 13 36 1 0 0 0 0 14 15 1 0 0 0 0 14 37 1 0 0 0 0 15 16 2 0 0 0 0 15 18 1 0 0 0 0 16 17 1 0 0 0 0 16 38 1 0 0 0 0 17 39 1 0 0 0 0 18 19 2 0 0 0 0 18 20 1 0 0 0 0 40 41 1 0 0 0 0 M CHG 1 18 1 M CHG 1 20 -1 M CHG 1 40 1 M END