IFLAB-ZINC05250513 MOE2007 3D CORINA 3.40 0006 02.08.2006 40 42 0 0 0 0 0 0 0 0999 V2000 -0.0190 1.5260 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 -1.3720 -0.5110 0.0120 N 0 0 0 0 0 0 0 0 0 0 0 0 -2.1490 -0.7880 -1.0780 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.3790 -1.2460 -0.5730 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.3790 -1.6080 -1.4980 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.1130 -1.4980 -2.7940 N 0 0 0 0 0 0 0 0 0 0 0 0 -2.9410 -1.0620 -3.2190 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.9760 -0.7130 -2.3950 N 0 0 0 0 0 0 0 0 0 0 0 0 -5.6090 -2.0660 -1.0660 N 0 0 0 0 0 0 0 0 0 0 0 0 -6.6370 -2.4380 -2.0410 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.8920 -2.9080 -1.3050 C 0 0 0 0 0 0 0 0 0 0 0 0 -8.9500 -3.2900 -2.3080 C 0 0 0 0 0 0 0 0 0 0 0 0 -9.0190 -4.5890 -2.7780 C 0 0 0 0 0 0 0 0 0 0 0 0 -9.9870 -4.9410 -3.6980 C 0 0 0 0 0 0 0 0 0 0 0 0 -10.8910 -3.9910 -4.1510 C 0 0 0 0 0 0 0 0 0 0 0 0 -10.8200 -2.6890 -3.6780 C 0 0 0 0 0 0 0 0 0 0 0 0 -9.8530 -2.3430 -2.7540 C 0 0 0 0 0 0 0 0 0 0 0 0 -11.8440 -4.3350 -5.0560 O 0 0 0 0 0 0 0 0 0 0 0 0 -12.7410 -3.3050 -5.4770 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.3040 -1.2320 0.7680 N 0 0 0 0 0 0 0 0 0 0 0 0 -2.1460 -0.8130 1.1430 N 0 0 0 0 0 0 0 0 0 0 0 0 1.0040 1.9030 0.0030 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5460 1.8870 -0.8730 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5290 1.8770 0.9070 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5120 -0.3560 -0.8950 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5290 -0.3650 0.8850 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.7680 -0.9880 -4.2820 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.7910 -2.1430 -0.1160 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.8800 -1.5730 -2.6590 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.2630 -3.2430 -2.6740 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.6490 -3.7730 -0.6870 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.2660 -2.1030 -0.6720 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.3150 -5.3280 -2.4260 H 0 0 0 0 0 0 0 0 0 0 0 0 -10.0400 -5.9560 -4.0650 H 0 0 0 0 0 0 0 0 0 0 0 0 -11.5220 -1.9470 -4.0280 H 0 0 0 0 0 0 0 0 0 0 0 0 -9.8000 -1.3300 -2.3810 H 0 0 0 0 0 0 0 0 0 0 0 0 -13.4490 -3.7130 -6.1980 H 0 0 0 0 0 0 0 0 0 0 0 0 -13.2830 -2.9200 -4.6140 H 0 0 0 0 0 0 0 0 0 0 0 0 -12.1740 -2.4970 -5.9410 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 23 1 0 0 0 0 1 24 1 0 0 0 0 1 25 1 0 0 0 0 2 3 1 0 0 0 0 2 26 1 0 0 0 0 2 27 1 0 0 0 0 3 4 1 0 0 0 0 3 22 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 21 1 0 0 0 0 6 7 1 0 0 0 0 6 10 1 0 0 0 0 7 8 2 0 0 0 0 8 9 1 0 0 0 0 8 28 1 0 0 0 0 10 11 1 0 0 0 0 10 29 1 0 0 0 0 11 12 1 0 0 0 0 11 30 1 0 0 0 0 11 31 1 0 0 0 0 12 13 1 0 0 0 0 12 32 1 0 0 0 0 12 33 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 34 1 0 0 0 0 15 16 1 0 0 0 0 15 35 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 36 1 0 0 0 0 18 37 1 0 0 0 0 19 20 1 0 0 0 0 20 38 1 0 0 0 0 20 39 1 0 0 0 0 20 40 1 0 0 0 0 21 22 2 0 0 0 0 M END