CHEMBRIDGE-ZINC04755995 MOE2007 3D CORINA 3.40 0006 02.08.2006 54 56 0 0 1 0 0 0 0 0999 V2000 0.1600 1.5490 -0.0500 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0490 0.0540 -0.0350 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1770 -0.7380 0.2120 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0840 -2.1310 0.1850 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.1370 -2.7520 -0.1060 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.2660 -1.9600 -0.3490 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.1710 -0.5680 -0.3240 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.2310 -4.2160 -0.1260 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.1660 -4.7490 1.1450 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.3430 -4.9540 -1.2400 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.3490 -4.4190 -2.6190 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.3470 -5.5790 -3.5610 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.2780 -5.4840 -4.7740 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.3790 -6.7210 -2.7940 N 0 0 0 0 0 0 0 0 0 0 0 0 -0.4160 -6.4670 -1.3590 C 0 0 3 0 0 0 0 0 0 0 0 0 0.5060 -6.8960 -0.9470 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.6350 -7.0750 -0.6870 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.4630 -8.0610 0.3030 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.5650 -8.6100 0.9650 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.8540 -8.1790 0.6350 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.0490 -7.2120 -0.3570 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.9410 -6.6670 -1.0150 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.0080 -8.7450 1.3380 N 0 3 0 0 0 0 0 0 0 0 0 0 -4.7860 -9.4720 2.3170 O 0 0 0 0 0 0 0 0 0 0 0 0 -6.1400 -8.4640 0.9170 O 0 5 0 0 0 0 0 0 0 0 0 0 -0.3250 -8.0540 -3.3850 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1210 -8.4730 -3.6880 C 0 0 0 0 0 0 0 0 0 0 0 0 0.8680 -9.5320 -5.9660 C 0 0 0 0 0 0 0 0 0 0 0 0 2.5290 -10.4280 -4.3590 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.3400 -3.2600 -3.0020 O 0 0 0 0 0 0 0 0 0 0 0 0 0.4100 1.8950 -1.0580 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.7810 2.0140 0.2610 H 0 0 0 0 0 0 0 0 0 0 0 0 0.9350 1.8910 0.6440 H 0 0 0 0 0 0 0 0 0 0 0 0 2.1360 -0.2730 0.4280 H 0 0 0 0 0 0 0 0 0 0 0 0 1.9710 -2.7260 0.3900 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.2250 -2.4220 -0.5730 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.0540 0.0310 -0.5340 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.4680 -8.4090 0.5760 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.3980 -9.3630 1.7330 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.0450 -6.8650 -0.6250 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.1120 -5.9130 -1.7810 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.8070 -8.7750 -2.7190 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9090 -8.0170 -4.3100 H 0 0 0 0 0 0 0 0 0 0 0 0 1.6720 -7.7030 -4.2390 H 0 0 0 0 0 0 0 0 0 0 0 0 1.6460 -8.6600 -2.7440 H 0 0 0 0 0 0 0 0 0 0 0 0 1.5940 -8.8270 -6.3800 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.1490 -9.1420 -6.0440 H 0 0 0 0 0 0 0 0 0 0 0 0 0.9270 -10.4980 -6.4740 H 0 0 0 0 0 0 0 0 0 0 0 0 2.6800 -10.6530 -3.3000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.3030 -9.7520 -4.7320 H 0 0 0 0 0 0 0 0 0 0 0 0 2.5060 -11.3580 -4.9340 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.4550 -5.6740 1.1520 H 0 0 0 0 0 0 0 0 0 0 0 0 1.1880 -9.7520 -4.5060 N 0 3 0 0 0 0 0 0 0 0 0 0 0.4890 -10.4110 -4.1340 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 31 1 0 0 0 0 1 32 1 0 0 0 0 1 33 1 0 0 0 0 2 3 1 0 0 0 0 2 7 2 0 0 0 0 3 4 2 0 0 0 0 3 34 1 0 0 0 0 4 5 1 0 0 0 0 4 35 1 0 0 0 0 5 6 2 0 0 0 0 5 8 1 0 0 0 0 6 7 1 0 0 0 0 6 36 1 0 0 0 0 7 37 1 0 0 0 0 8 9 1 0 0 0 0 8 10 2 0 0 0 0 9 52 1 0 0 0 0 10 11 1 0 0 0 0 10 15 1 0 0 0 0 11 12 1 0 0 0 0 11 30 2 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 26 1 0 0 0 0 15 16 1 0 0 0 0 15 17 1 0 0 0 0 17 18 1 0 0 0 0 17 22 2 0 0 0 0 18 19 2 0 0 0 0 18 38 1 0 0 0 0 19 20 1 0 0 0 0 19 39 1 0 0 0 0 20 21 2 0 0 0 0 20 23 1 0 0 0 0 21 22 1 0 0 0 0 21 40 1 0 0 0 0 22 41 1 0 0 0 0 23 24 2 0 0 0 0 23 25 1 0 0 0 0 26 27 1 0 0 0 0 26 42 1 0 0 0 0 26 43 1 0 0 0 0 27 44 1 0 0 0 0 27 45 1 0 0 0 0 27 53 1 0 0 0 0 28 46 1 0 0 0 0 28 47 1 0 0 0 0 28 48 1 0 0 0 0 28 53 1 0 0 0 0 29 49 1 0 0 0 0 29 50 1 0 0 0 0 29 51 1 0 0 0 0 29 53 1 0 0 0 0 53 54 1 0 0 0 0 M CHG 1 23 1 M CHG 1 25 -1 M CHG 1 53 1 M END