IFLAB-ZINC02457367 MOE2007 3D CORINA 3.40 0006 02.08.2006 46 48 0 0 0 0 0 0 0 0999 V2000 -0.5970 1.9310 1.2900 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.4880 0.4380 1.3610 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.2500 -0.1990 2.5770 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.1270 -1.5900 2.6290 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.2310 -2.3890 1.4760 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.4230 -1.7390 0.2390 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.5620 -0.3370 0.1990 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.4670 -2.4910 -1.0630 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.1360 -3.7620 1.6000 N 0 0 0 0 0 0 0 0 0 0 0 0 -1.2480 -4.6460 1.2410 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.7460 -5.8580 0.4460 C 0 0 0 0 0 0 0 0 0 0 0 0 0.4000 -6.5040 1.0880 N 0 0 0 0 0 0 0 0 0 0 0 0 1.5130 -5.5950 1.4090 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0410 -4.3750 2.2200 C 0 0 0 0 0 0 0 0 0 0 0 0 0.3570 -7.8720 1.3410 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.6440 -8.5680 1.2020 O 0 0 0 0 0 0 0 0 0 0 0 0 1.5860 -8.5430 1.7960 C 0 0 0 0 0 0 0 0 0 0 0 0 1.5950 -9.1600 3.0470 C 0 0 0 0 0 0 0 0 0 0 0 0 2.7500 -9.8150 3.4770 C 0 0 0 0 0 0 0 0 0 0 0 0 3.8940 -9.8720 2.6610 C 0 0 0 0 0 0 0 0 0 0 0 0 3.8510 -9.2630 1.3950 C 0 0 0 0 0 0 0 0 0 0 0 0 2.7000 -8.6060 0.9580 C 0 0 0 0 0 0 0 0 0 0 0 0 5.1430 -10.5840 3.1320 C 0 0 0 0 0 0 0 0 0 0 0 0 5.1150 -11.0900 4.2980 O 0 5 0 0 0 0 0 0 0 0 0 0 0.3900 2.3710 1.1120 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.2710 2.2360 0.4820 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0030 2.3400 2.2210 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.1670 0.3760 3.4960 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0280 -2.0640 3.5960 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.7180 0.1580 -0.7590 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.4580 -2.9240 -1.2230 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.2480 -1.8300 -1.9090 H 0 0 0 0 0 0 0 0 0 0 0 0 0.2910 -3.2800 -1.0840 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.7160 -4.9930 2.1700 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.0280 -4.1280 0.6740 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.5680 -6.5660 0.2980 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.4100 -5.5440 -0.5490 H 0 0 0 0 0 0 0 0 0 0 0 0 2.3000 -6.1030 1.9700 H 0 0 0 0 0 0 0 0 0 0 0 0 1.9380 -5.2670 0.4520 H 0 0 0 0 0 0 0 0 0 0 0 0 1.8740 -3.6660 2.2990 H 0 0 0 0 0 0 0 0 0 0 0 0 0.7770 -4.6900 3.2370 H 0 0 0 0 0 0 0 0 0 0 0 0 0.7170 -9.1350 3.6850 H 0 0 0 0 0 0 0 0 0 0 0 0 2.7640 -10.2930 4.4560 H 0 0 0 0 0 0 0 0 0 0 0 0 4.7230 -9.3100 0.7450 H 0 0 0 0 0 0 0 0 0 0 0 0 2.6800 -8.1510 -0.0290 H 0 0 0 0 0 0 0 0 0 0 0 0 6.1260 -10.6260 2.3270 O 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 25 1 0 0 0 0 1 26 1 0 0 0 0 1 27 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 28 1 0 0 0 0 4 5 1 0 0 0 0 4 29 1 0 0 0 0 5 6 2 0 0 0 0 5 9 1 0 0 0 0 6 7 1 0 0 0 0 6 8 1 0 0 0 0 7 30 1 0 0 0 0 8 31 1 0 0 0 0 8 32 1 0 0 0 0 8 33 1 0 0 0 0 9 10 1 0 0 0 0 9 14 1 0 0 0 0 10 11 1 0 0 0 0 10 34 1 0 0 0 0 10 35 1 0 0 0 0 11 12 1 0 0 0 0 11 36 1 0 0 0 0 11 37 1 0 0 0 0 12 13 1 0 0 0 0 12 15 1 0 0 0 0 13 14 1 0 0 0 0 13 38 1 0 0 0 0 13 39 1 0 0 0 0 14 40 1 0 0 0 0 14 41 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 22 2 0 0 0 0 18 19 2 0 0 0 0 18 42 1 0 0 0 0 19 20 1 0 0 0 0 19 43 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 44 1 0 0 0 0 22 45 1 0 0 0 0 23 24 1 0 0 0 0 23 46 2 0 0 0 0 M CHG 1 24 -1 M END