CHEMBRIDGE-ZINC04120579 MOE2007 3D CORINA 3.40 0006 02.08.2006 53 55 0 0 0 0 0 0 0 0999 V2000 0.4290 1.8810 0.2940 C 0 0 0 0 0 0 0 0 0 0 0 0 0.2480 0.3630 0.2380 C 0 0 0 0 0 0 0 0 0 0 0 0 0.9870 -0.2820 1.4130 C 0 0 0 0 0 0 0 0 0 0 0 0 0.8090 -1.7780 1.3580 C 0 0 0 0 0 0 0 0 0 0 0 0 0.1560 -2.2780 0.4660 O 0 0 0 0 0 0 0 0 0 0 0 0 1.3750 -2.5590 2.2980 N 0 0 0 0 0 0 0 0 0 0 0 0 1.2140 -4.0200 2.2630 C 0 0 0 0 0 0 0 0 0 0 0 0 0.7330 -4.4900 3.6400 C 0 0 0 0 0 0 0 0 0 0 0 0 1.6510 -3.9920 4.6720 N 0 0 0 0 0 0 0 0 0 0 0 0 1.6520 -2.5230 4.7200 C 0 0 0 0 0 0 0 0 0 0 0 0 2.1760 -1.9730 3.3840 C 0 0 0 0 0 0 0 0 0 0 0 0 1.3400 -4.5340 5.9240 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0940 -4.1860 7.0380 C 0 0 0 0 0 0 0 0 0 0 0 0 1.7870 -4.7210 8.2730 C 0 0 0 0 0 0 0 0 0 0 0 0 0.7240 -5.6060 8.4020 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0290 -5.9540 7.2880 C 0 0 0 0 0 0 0 0 0 0 0 0 0.2750 -5.4150 6.0540 C 0 0 0 0 0 0 0 0 0 0 0 0 0.4130 -6.1480 9.6550 N 0 0 0 0 0 0 0 0 0 0 0 0 -0.0770 -7.4010 9.7440 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.1590 -8.0940 8.7490 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.5150 -7.9310 11.0530 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.0230 -9.2280 11.1490 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.4300 -9.7170 12.3730 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.3360 -8.9260 13.5040 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.8330 -7.6400 13.4150 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.4180 -7.1400 12.1980 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.7750 -9.4570 14.8140 N 0 3 0 0 0 0 0 0 0 0 0 0 -2.2180 -10.5880 14.8940 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.6930 -8.7620 15.8110 O 0 5 0 0 0 0 0 0 0 0 0 0 1.4900 2.1240 0.2340 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0970 2.3410 -0.5420 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0230 2.2610 1.2320 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.8130 0.1210 0.2990 H 0 0 0 0 0 0 0 0 0 0 0 0 0.6550 -0.0170 -0.6990 H 0 0 0 0 0 0 0 0 0 0 0 0 2.0480 -0.0400 1.3520 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5800 0.0980 2.3500 H 0 0 0 0 0 0 0 0 0 0 0 0 0.4770 -4.2890 1.5060 H 0 0 0 0 0 0 0 0 0 0 0 0 2.1700 -4.4890 2.0300 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.2690 -4.1040 3.8270 H 0 0 0 0 0 0 0 0 0 0 0 0 0.7140 -5.5800 3.6660 H 0 0 0 0 0 0 0 0 0 0 0 0 0.6380 -2.1640 4.8920 H 0 0 0 0 0 0 0 0 0 0 0 0 2.3000 -2.1860 5.5300 H 0 0 0 0 0 0 0 0 0 0 0 0 3.2230 -2.2480 3.2560 H 0 0 0 0 0 0 0 0 0 0 0 0 2.0750 -0.8880 3.3690 H 0 0 0 0 0 0 0 0 0 0 0 0 2.9200 -3.4980 6.9370 H 0 0 0 0 0 0 0 0 0 0 0 0 2.3730 -4.4510 9.1390 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.8540 -6.6430 7.3880 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.3140 -5.6820 5.1890 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5500 -5.6230 10.4590 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0980 -9.8470 10.2670 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.8230 -10.7200 12.4480 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.7620 -7.0270 14.3020 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0210 -6.1380 12.1320 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 35 1 0 0 0 0 3 36 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 11 1 0 0 0 0 7 8 1 0 0 0 0 7 37 1 0 0 0 0 7 38 1 0 0 0 0 8 9 1 0 0 0 0 8 39 1 0 0 0 0 8 40 1 0 0 0 0 9 10 1 0 0 0 0 9 12 1 0 0 0 0 10 11 1 0 0 0 0 10 41 1 0 0 0 0 10 42 1 0 0 0 0 11 43 1 0 0 0 0 11 44 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 45 1 0 0 0 0 14 15 1 0 0 0 0 14 46 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 47 1 0 0 0 0 17 48 1 0 0 0 0 18 19 1 0 0 0 0 18 49 1 0 0 0 0 19 20 2 0 0 0 0 19 21 1 0 0 0 0 21 22 1 0 0 0 0 21 26 2 0 0 0 0 22 23 2 0 0 0 0 22 50 1 0 0 0 0 23 24 1 0 0 0 0 23 51 1 0 0 0 0 24 25 2 0 0 0 0 24 27 1 0 0 0 0 25 26 1 0 0 0 0 25 52 1 0 0 0 0 26 53 1 0 0 0 0 27 28 2 0 0 0 0 27 29 1 0 0 0 0 M CHG 1 27 1 M CHG 1 29 -1 M END