CHEMBRIDGE-ZINC04981104 MOE2007 3D CORINA 3.40 0006 02.08.2006 52 54 0 0 1 0 0 0 0 0999 V2000 -0.0180 1.5030 0.0100 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0020 -0.0040 0.0020 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1450 -0.6440 -0.0120 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.2930 -0.7750 0.0100 C 0 0 3 0 0 0 0 0 0 0 0 0 -1.0820 -1.8450 0.0020 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.1220 -0.4040 -1.2260 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.3410 -1.3270 -1.2860 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.0330 -1.3560 0.0460 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.4910 -0.9630 1.1540 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.0960 -0.4180 1.2630 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.4470 -1.8750 0.0960 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.7420 -1.3000 -0.4200 C 0 0 0 0 0 0 0 0 0 0 0 0 -8.6650 -0.1500 -0.8310 C 0 0 0 0 0 0 0 0 0 0 0 0 -8.6400 0.8890 0.2070 N 0 0 0 0 0 0 0 0 0 0 0 0 -7.2770 1.4030 0.4010 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.3550 0.2530 0.8120 C 0 0 0 0 0 0 0 0 0 0 0 0 -9.5270 1.9240 -0.0990 C 0 0 0 0 0 0 0 0 0 0 0 0 -9.6540 3.0090 0.7600 C 0 0 0 0 0 0 0 0 0 0 0 0 -10.5320 4.0300 0.4540 C 0 0 0 0 0 0 0 0 0 0 0 0 -11.2830 3.9740 -0.7050 C 0 0 0 0 0 0 0 0 0 0 0 0 -11.1590 2.8960 -1.5620 C 0 0 0 0 0 0 0 0 0 0 0 0 -10.2790 1.8740 -1.2660 C 0 0 0 0 0 0 0 0 0 0 0 0 -12.2240 5.0700 -1.0300 N 0 3 0 0 0 0 0 0 0 0 0 0 -12.3340 6.0200 -0.2760 O 0 0 0 0 0 0 0 0 0 0 0 0 -12.8860 5.0220 -2.0500 O 0 5 0 0 0 0 0 0 0 0 0 0 1.0040 1.8800 0.0030 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5460 1.8640 -0.8730 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5290 1.8540 0.9070 H 0 0 0 0 0 0 0 0 0 0 0 0 1.1600 -1.7230 -0.0180 H 0 0 0 0 0 0 0 0 0 0 0 0 2.0730 -0.0910 -0.0180 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.4500 0.6320 -1.1490 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.5190 -0.5350 -2.1240 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.0330 -0.9620 -2.0450 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.0190 -2.3350 -1.5480 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.0780 -1.0350 2.0580 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.6060 -0.8420 2.1390 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.1420 0.6660 1.3660 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.5650 -2.6800 -0.6290 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.6610 -2.2520 1.0960 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.1010 -1.7400 0.5100 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.7370 -2.0590 -1.2030 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.3220 0.2720 -1.7760 H 0 0 0 0 0 0 0 0 0 0 0 0 -9.6820 -0.5240 -0.9480 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.9180 1.8430 -0.5290 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.2830 2.1620 1.1840 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.3370 0.6270 0.9280 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.6980 -0.1680 1.7570 H 0 0 0 0 0 0 0 0 0 0 0 0 -9.0680 3.0530 1.6660 H 0 0 0 0 0 0 0 0 0 0 0 0 -10.6310 4.8740 1.1210 H 0 0 0 0 0 0 0 0 0 0 0 0 -11.7480 2.8550 -2.4670 H 0 0 0 0 0 0 0 0 0 0 0 0 -10.1790 1.0340 -1.9380 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.3800 -0.7860 -0.2260 N 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 26 1 0 0 0 0 1 27 1 0 0 0 0 1 28 1 0 0 0 0 2 3 2 0 0 0 0 2 4 1 0 0 0 0 3 29 1 0 0 0 0 3 30 1 0 0 0 0 4 5 1 0 0 0 0 4 6 1 0 0 0 0 4 10 1 0 0 0 0 6 7 1 0 0 0 0 6 31 1 0 0 0 0 6 32 1 0 0 0 0 7 8 1 0 0 0 0 7 33 1 0 0 0 0 7 34 1 0 0 0 0 8 9 2 0 0 0 0 8 11 1 0 0 0 0 9 10 1 0 0 0 0 9 35 1 0 0 0 0 10 36 1 0 0 0 0 10 37 1 0 0 0 0 11 38 1 0 0 0 0 11 39 1 0 0 0 0 11 52 1 0 0 0 0 12 13 1 0 0 0 0 12 40 1 0 0 0 0 12 41 1 0 0 0 0 12 52 1 0 0 0 0 13 14 1 0 0 0 0 13 42 1 0 0 0 0 13 43 1 0 0 0 0 14 15 1 0 0 0 0 14 17 1 0 0 0 0 15 16 1 0 0 0 0 15 44 1 0 0 0 0 15 45 1 0 0 0 0 16 46 1 0 0 0 0 16 47 1 0 0 0 0 16 52 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 48 1 0 0 0 0 19 20 1 0 0 0 0 19 49 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 50 1 0 0 0 0 22 51 1 0 0 0 0 23 24 2 0 0 0 0 23 25 1 0 0 0 0 M CHG 1 23 1 M CHG 1 25 -1 M END