IFLAB-ZINC04339790 MOE2007 3D CORINA 3.40 0006 02.08.2006 56 59 0 0 0 0 0 0 0 0999 V2000 3.3290 1.6630 1.5920 C 0 0 0 0 0 0 0 0 0 0 0 0 3.1150 0.2360 2.0620 C 0 0 0 0 0 0 0 0 0 0 0 0 2.7840 -0.5580 0.9230 O 0 0 0 0 0 0 0 0 0 0 0 0 2.5840 -1.8960 1.1290 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3300 -2.6380 -0.0270 C 0 0 0 0 0 0 0 0 0 0 0 0 2.1130 -4.0190 0.0390 C 0 0 0 0 0 0 0 0 0 0 0 0 2.1300 -4.6800 1.2700 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3940 -3.9340 2.4270 C 0 0 0 0 0 0 0 0 0 0 0 0 2.6140 -2.5520 2.3590 C 0 0 0 0 0 0 0 0 0 0 0 0 1.9470 -6.1300 1.3900 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0250 -6.8490 0.7460 C 0 0 0 0 0 0 0 0 0 0 0 0 0.8710 -8.3060 0.9210 C 0 0 0 0 0 0 0 0 0 0 0 0 1.5120 -9.0660 1.6250 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.2380 -8.6370 0.0570 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.8330 -9.8520 -0.1940 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.9050 -9.8650 -1.0890 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.3410 -8.6690 -1.6900 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.7340 -7.4290 -1.4190 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.6670 -7.4500 -0.5400 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0760 -6.3600 -0.1450 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.1780 -6.1600 -2.0850 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.1000 -5.0460 -3.2650 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.6310 -5.0490 -3.4020 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.8880 -5.7520 -1.0920 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.3660 -5.7570 -0.8920 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.7570 -4.7870 -2.2830 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.4120 -8.6790 -2.5520 O 0 0 0 0 0 0 0 0 0 0 0 0 2.4260 2.0490 1.1070 H 0 0 0 0 0 0 0 0 0 0 0 0 3.5850 2.3160 2.4310 H 0 0 0 0 0 0 0 0 0 0 0 0 4.1330 1.7090 0.8500 H 0 0 0 0 0 0 0 0 0 0 0 0 4.0380 -0.1300 2.5270 H 0 0 0 0 0 0 0 0 0 0 0 0 2.2940 0.2170 2.7890 H 0 0 0 0 0 0 0 0 0 0 0 0 2.3090 -2.1380 -0.9930 H 0 0 0 0 0 0 0 0 0 0 0 0 1.9430 -4.5640 -0.8860 H 0 0 0 0 0 0 0 0 0 0 0 0 2.4290 -4.4220 3.4000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.8080 -2.0220 3.2860 H 0 0 0 0 0 0 0 0 0 0 0 0 2.6170 -6.6290 2.0890 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.4840 -10.7610 0.2840 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.3950 -10.8120 -1.3040 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.8360 -5.2660 -1.5520 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.7620 -6.1400 -3.0990 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.6330 -5.3470 -4.2090 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.7210 -4.0640 -2.9620 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.9080 -4.2780 -4.1310 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.9550 -6.0160 -3.8110 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.2220 -6.7630 -1.3590 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.3550 -5.4960 -0.1340 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.0010 -4.7880 -0.5320 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.0790 -6.5410 -0.1850 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.1310 -5.7610 -2.6200 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.0650 -4.0280 -3.0100 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.2510 -4.5360 -1.3370 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.6470 -9.6110 -2.7300 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.6780 -6.0430 -2.2120 N 0 3 0 0 0 0 0 0 0 0 0 0 -3.9740 -6.9900 -2.5240 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.3020 -4.7810 -2.1190 N 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 37 1 0 0 0 0 11 12 1 0 0 0 0 11 20 1 0 0 0 0 12 13 2 0 0 0 0 12 14 1 0 0 0 0 14 15 1 0 0 0 0 14 19 2 0 0 0 0 15 16 2 0 0 0 0 15 38 1 0 0 0 0 16 17 1 0 0 0 0 16 39 1 0 0 0 0 17 18 2 0 0 0 0 17 27 1 0 0 0 0 18 19 1 0 0 0 0 18 21 1 0 0 0 0 19 20 1 0 0 0 0 21 40 1 0 0 0 0 21 41 1 0 0 0 0 21 54 1 0 0 0 0 22 23 1 0 0 0 0 22 42 1 0 0 0 0 22 43 1 0 0 0 0 22 54 1 0 0 0 0 23 44 1 0 0 0 0 23 45 1 0 0 0 0 23 56 1 0 0 0 0 24 25 1 0 0 0 0 24 46 1 0 0 0 0 24 47 1 0 0 0 0 24 56 1 0 0 0 0 25 48 1 0 0 0 0 25 49 1 0 0 0 0 25 54 1 0 0 0 0 26 50 1 0 0 0 0 26 51 1 0 0 0 0 26 52 1 0 0 0 0 26 56 1 0 0 0 0 27 53 1 0 0 0 0 54 55 1 0 0 0 0 M CHG 1 54 1 M END