IFLAB-ZINC02961368 MOE2007 3D CORINA 3.40 0006 02.08.2006 44 47 0 0 0 0 0 0 0 0999 V2000 -0.0470 1.5340 0.1230 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0970 0.0120 0.0700 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0350 -0.5250 1.3880 O 0 0 0 0 0 0 0 0 0 0 0 0 0.0680 -1.8720 1.5170 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0510 -2.4590 2.7720 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0540 -3.8250 2.9080 C 0 0 0 0 0 0 0 0 0 0 0 0 0.2790 -4.6220 1.7820 C 0 0 0 0 0 0 0 0 0 0 0 0 0.3980 -4.0280 0.5230 C 0 0 0 0 0 0 0 0 0 0 0 0 0.2870 -2.6620 0.3950 C 0 0 0 0 0 0 0 0 0 0 0 0 0.3920 -6.0870 1.9230 C 0 0 0 0 0 0 0 0 0 0 0 0 0.2890 -6.6020 3.0200 O 0 0 0 0 0 0 0 0 0 0 0 0 0.6090 -6.8540 0.8370 N 0 0 0 0 0 0 0 0 0 0 0 0 0.8260 -8.2250 0.9820 C 0 0 0 0 0 0 0 0 0 0 0 0 0.3790 -9.1060 0.0040 C 0 0 0 0 0 0 0 0 0 0 0 0 0.5910 -10.4600 0.1440 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2560 -10.9470 1.2710 C 0 0 0 0 0 0 0 0 0 0 0 0 1.7040 -10.0600 2.2520 C 0 0 0 0 0 0 0 0 0 0 0 0 1.4940 -8.7070 2.1030 C 0 0 0 0 0 0 0 0 0 0 0 0 1.4850 -12.3990 1.4260 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0870 -12.9470 2.4270 N 0 0 0 0 0 0 0 0 0 0 0 0 2.2180 -14.2840 2.4250 C 0 0 0 0 0 0 0 0 0 0 0 0 2.8270 -15.1210 3.3880 C 0 0 0 0 0 0 0 0 0 0 0 0 2.8410 -16.4800 3.1700 C 0 0 0 0 0 0 0 0 0 0 0 0 2.2630 -16.9980 2.0220 C 0 0 0 0 0 0 0 0 0 0 0 0 1.7000 -16.2080 1.1340 N 0 0 0 0 0 0 0 0 0 0 0 0 1.6570 -14.8890 1.2930 C 0 0 0 0 0 0 0 0 0 0 0 0 0.9680 -13.6240 0.2760 S 0 0 0 0 0 0 0 0 0 0 0 0 0.7290 1.9500 0.7640 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0530 1.9430 -0.8820 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0270 1.7920 0.5240 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.6800 -0.4050 -0.5720 H 0 0 0 0 0 0 0 0 0 0 0 0 1.0770 -0.2470 -0.3310 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.2250 -1.8420 3.6410 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0380 -4.2800 3.8830 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5720 -4.6410 -0.3500 H 0 0 0 0 0 0 0 0 0 0 0 0 0.3740 -2.2030 -0.5790 H 0 0 0 0 0 0 0 0 0 0 0 0 0.6150 -6.4530 -0.0470 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.1360 -8.7280 -0.8680 H 0 0 0 0 0 0 0 0 0 0 0 0 0.2420 -11.1430 -0.6160 H 0 0 0 0 0 0 0 0 0 0 0 0 2.2190 -10.4340 3.1250 H 0 0 0 0 0 0 0 0 0 0 0 0 1.8440 -8.0200 2.8590 H 0 0 0 0 0 0 0 0 0 0 0 0 3.2730 -14.7010 4.2770 H 0 0 0 0 0 0 0 0 0 0 0 0 3.3010 -17.1400 3.8910 H 0 0 0 0 0 0 0 0 0 0 0 0 2.2750 -18.0650 1.8540 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 28 1 0 0 0 0 1 29 1 0 0 0 0 1 30 1 0 0 0 0 2 3 1 0 0 0 0 2 31 1 0 0 0 0 2 32 1 0 0 0 0 3 4 1 0 0 0 0 4 5 1 0 0 0 0 4 9 2 0 0 0 0 5 6 2 0 0 0 0 5 33 1 0 0 0 0 6 7 1 0 0 0 0 6 34 1 0 0 0 0 7 8 2 0 0 0 0 7 10 1 0 0 0 0 8 9 1 0 0 0 0 8 35 1 0 0 0 0 9 36 1 0 0 0 0 10 11 2 0 0 0 0 10 12 1 0 0 0 0 12 13 1 0 0 0 0 12 37 1 0 0 0 0 13 14 1 0 0 0 0 13 18 2 0 0 0 0 14 15 2 0 0 0 0 14 38 1 0 0 0 0 15 16 1 0 0 0 0 15 39 1 0 0 0 0 16 17 2 0 0 0 0 16 19 1 0 0 0 0 17 18 1 0 0 0 0 17 40 1 0 0 0 0 18 41 1 0 0 0 0 19 20 2 0 0 0 0 19 27 1 0 0 0 0 20 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 42 1 0 0 0 0 23 24 1 0 0 0 0 23 43 1 0 0 0 0 24 25 2 0 0 0 0 24 44 1 0 0 0 0 25 26 1 0 0 0 0 26 27 1 0 0 0 0 M END