IFLAB-ZINC04263423 MOE2007 3D CORINA 3.40 0006 02.08.2006 49 51 0 0 0 0 0 0 0 0999 V2000 0.4220 1.8110 -0.5070 C 0 0 0 0 0 0 0 0 0 0 0 0 0.4170 0.2820 -0.4470 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0770 -0.2790 -1.7080 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0720 -1.8080 -1.6490 C 0 0 0 0 0 0 0 0 0 0 0 0 1.7040 -2.3460 -2.8560 N 0 0 0 0 0 0 0 0 0 0 0 0 1.8120 -3.6790 -3.0240 C 0 0 0 0 0 0 0 0 0 0 0 0 1.3880 -4.4330 -2.1740 O 0 0 0 0 0 0 0 0 0 0 0 0 2.4620 -4.2320 -4.2660 C 0 0 0 0 0 0 0 0 0 0 0 0 2.4580 -5.7600 -4.2060 C 0 0 0 0 0 0 0 0 0 0 0 0 3.1170 -6.3220 -5.4680 C 0 0 0 0 0 0 0 0 0 0 0 0 3.1130 -7.7860 -5.4100 N 0 0 0 0 0 0 0 0 0 0 0 0 2.0950 -8.4690 -5.9080 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1350 -7.9290 -6.4250 O 0 0 0 0 0 0 0 0 0 0 0 0 2.2110 -9.9270 -5.7900 C 0 0 0 0 0 0 0 0 0 0 0 0 1.3300 -10.8710 -6.2070 C 0 0 0 0 0 0 0 0 0 0 0 0 1.6940 -12.2930 -6.1480 C 0 0 0 0 0 0 0 0 0 0 0 0 0.6960 -13.2740 -6.1460 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0410 -14.6060 -6.0900 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3770 -14.9820 -6.0360 C 0 0 0 0 0 0 0 0 0 0 0 0 3.3780 -14.0090 -6.0380 C 0 0 0 0 0 0 0 0 0 0 0 0 3.0420 -12.6710 -6.0990 C 0 0 0 0 0 0 0 0 0 0 0 0 4.5920 -14.6320 -5.9780 O 0 0 0 0 0 0 0 0 0 0 0 0 4.3390 -16.0000 -6.3530 C 0 0 0 0 0 0 0 0 0 0 0 0 2.9660 -16.2110 -5.9750 O 0 0 0 0 0 0 0 0 0 0 0 0 3.7700 -10.1710 -4.9760 S 0 0 0 0 0 0 0 0 0 0 0 0 4.1410 -8.4420 -4.8600 C 0 0 0 0 0 0 0 0 0 0 0 0 5.5440 -7.7440 -4.1720 S 0 0 0 0 0 0 0 0 0 0 0 0 1.4490 2.1690 -0.5700 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.1330 2.1420 -1.3850 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0480 2.2110 0.3920 H 0 0 0 0 0 0 0 0 0 0 0 0 0.9720 -0.0490 0.4310 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.6100 -0.0760 -0.3840 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5220 0.0520 -2.5860 H 0 0 0 0 0 0 0 0 0 0 0 0 2.1040 0.0790 -1.7710 H 0 0 0 0 0 0 0 0 0 0 0 0 1.6270 -2.1390 -0.7710 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0440 -2.1660 -1.5860 H 0 0 0 0 0 0 0 0 0 0 0 0 2.0430 -1.7420 -3.5360 H 0 0 0 0 0 0 0 0 0 0 0 0 1.9080 -3.9000 -5.1440 H 0 0 0 0 0 0 0 0 0 0 0 0 3.4900 -3.8740 -4.3290 H 0 0 0 0 0 0 0 0 0 0 0 0 3.0120 -6.0920 -3.3280 H 0 0 0 0 0 0 0 0 0 0 0 0 1.4300 -6.1180 -4.1440 H 0 0 0 0 0 0 0 0 0 0 0 0 2.5630 -5.9910 -6.3460 H 0 0 0 0 0 0 0 0 0 0 0 0 4.1450 -5.9640 -5.5300 H 0 0 0 0 0 0 0 0 0 0 0 0 0.3610 -10.5780 -6.5820 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.3440 -12.9870 -6.1870 H 0 0 0 0 0 0 0 0 0 0 0 0 0.2700 -15.3620 -6.0880 H 0 0 0 0 0 0 0 0 0 0 0 0 3.8160 -11.9180 -6.1050 H 0 0 0 0 0 0 0 0 0 0 0 0 4.4650 -16.1310 -7.4280 H 0 0 0 0 0 0 0 0 0 0 0 0 4.9960 -16.6740 -5.8040 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 3 33 1 0 0 0 0 3 34 1 0 0 0 0 4 5 1 0 0 0 0 4 35 1 0 0 0 0 4 36 1 0 0 0 0 5 6 1 0 0 0 0 5 37 1 0 0 0 0 6 7 2 0 0 0 0 6 8 1 0 0 0 0 8 9 1 0 0 0 0 8 38 1 0 0 0 0 8 39 1 0 0 0 0 9 10 1 0 0 0 0 9 40 1 0 0 0 0 9 41 1 0 0 0 0 10 11 1 0 0 0 0 10 42 1 0 0 0 0 10 43 1 0 0 0 0 11 12 1 0 0 0 0 11 26 1 0 0 0 0 12 13 2 0 0 0 0 12 14 1 0 0 0 0 14 15 2 0 0 0 0 14 25 1 0 0 0 0 15 16 1 0 0 0 0 15 44 1 0 0 0 0 16 17 1 0 0 0 0 16 21 2 0 0 0 0 17 18 2 0 0 0 0 17 45 1 0 0 0 0 18 19 1 0 0 0 0 18 46 1 0 0 0 0 19 20 2 0 0 0 0 19 24 1 0 0 0 0 20 21 1 0 0 0 0 20 22 1 0 0 0 0 21 47 1 0 0 0 0 22 23 1 0 0 0 0 23 24 1 0 0 0 0 23 48 1 0 0 0 0 23 49 1 0 0 0 0 25 26 1 0 0 0 0 26 27 2 0 0 0 0 M END