IFLAB-ZINC04517767 MOE2007 3D CORINA 3.40 0006 02.08.2006 44 46 0 0 0 0 0 0 0 0999 V2000 -0.0240 1.5030 0.0110 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 0.1160 -0.6150 1.0440 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.1020 -0.6730 -1.1630 N 0 0 0 0 0 0 0 0 0 0 0 0 -0.1940 -2.1410 -1.1900 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.5620 -2.5390 -1.7480 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.8500 -1.7210 -2.9960 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.2180 -0.5800 -3.3010 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.8180 0.0830 -4.8110 S 0 0 0 0 0 0 0 0 0 0 0 0 -2.9240 -1.1930 -5.0260 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.8400 -2.0840 -3.9930 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.6510 -3.2600 -3.9030 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.2950 -4.1940 -3.8320 N 0 0 0 0 0 0 0 0 0 0 0 0 -3.7910 -1.3120 -6.1020 N 0 0 0 0 0 0 0 0 0 0 0 0 -3.7940 -0.3760 -7.0710 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.0370 0.5720 -7.0030 O 0 0 0 0 0 0 0 0 0 0 0 0 -4.7180 -0.5030 -8.2180 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.5890 -1.5920 -8.2990 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.4490 -1.7040 -9.3720 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.4500 -0.7410 -10.3650 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.5900 0.3400 -10.2910 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.7280 0.4670 -9.2210 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.6390 1.8490 -9.1240 S 0 0 0 0 0 0 0 0 0 0 0 0 -2.3600 1.2710 -8.8980 O 0 0 0 0 0 0 0 0 0 0 0 0 -3.9090 2.5920 -10.3050 O 0 0 0 0 0 0 0 0 0 0 0 0 -4.1940 2.7610 -7.6570 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.1320 0.0420 -2.4490 C 0 0 0 0 0 0 0 0 0 0 0 0 0.9790 1.8840 -0.1820 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.7030 1.8590 -0.7640 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.3660 1.8550 0.9840 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5920 -2.5450 -1.8280 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0840 -2.5320 -0.1790 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.5580 -3.6000 -2.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.3310 -2.3450 -1.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.3950 -2.0690 -6.1560 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.5890 -2.3440 -7.5240 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.1230 -2.5460 -9.4360 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.1260 -0.8340 -11.2030 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.5960 1.0880 -11.0700 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.1160 2.1190 -6.7800 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.5680 3.6420 -7.5190 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.2310 3.0690 -7.7920 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.3540 1.0960 -2.2800 H 0 0 0 0 0 0 0 0 0 0 0 0 0.8300 -0.0580 -2.9500 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 2 0 0 0 0 2 4 1 0 0 0 0 4 5 1 0 0 0 0 4 27 1 0 0 0 0 5 6 1 0 0 0 0 5 31 1 0 0 0 0 5 32 1 0 0 0 0 6 7 1 0 0 0 0 6 33 1 0 0 0 0 6 34 1 0 0 0 0 7 8 2 0 0 0 0 7 11 1 0 0 0 0 8 9 1 0 0 0 0 8 27 1 0 0 0 0 9 10 1 0 0 0 0 10 11 2 0 0 0 0 10 14 1 0 0 0 0 11 12 1 0 0 0 0 12 13 3 0 0 0 0 14 15 1 0 0 0 0 14 35 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 36 1 0 0 0 0 19 20 1 0 0 0 0 19 37 1 0 0 0 0 20 21 2 0 0 0 0 20 38 1 0 0 0 0 21 22 1 0 0 0 0 21 39 1 0 0 0 0 22 23 1 0 0 0 0 23 24 2 0 0 0 0 23 25 2 0 0 0 0 23 26 1 0 0 0 0 26 40 1 0 0 0 0 26 41 1 0 0 0 0 26 42 1 0 0 0 0 27 43 1 0 0 0 0 27 44 1 0 0 0 0 M END