IFLAB-ZINC04120104 MOE2007 3D CORINA 3.40 0006 02.08.2006 49 51 0 0 0 0 0 0 0 0999 V2000 -8.7710 -9.5750 -2.5960 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.5780 -8.8620 -3.2350 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.8220 -8.7080 -4.7380 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.4220 -7.5710 -2.6430 O 0 0 0 0 0 0 0 0 0 0 0 0 -6.1550 -7.1000 -2.5170 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.9220 -5.9100 -1.8390 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.6390 -5.4290 -1.7090 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.5690 -6.1400 -2.2600 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.8070 -7.3370 -2.9410 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.0940 -7.8130 -3.0620 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.1920 -5.6280 -2.1230 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.9680 -4.6670 -1.4130 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.1820 -6.2260 -2.7860 N 0 0 0 0 0 0 0 0 0 0 0 0 -1.2850 -7.4590 -3.5840 C 0 0 0 0 0 0 0 0 0 0 0 0 0.1530 -7.6690 -4.0990 C 0 0 0 0 0 0 0 0 0 0 0 0 0.9040 -6.5380 -3.5370 N 0 0 0 0 0 0 0 0 0 0 0 0 0.1190 -5.7870 -2.8360 C 0 0 0 0 0 0 0 0 0 0 0 0 0.6710 -4.3300 -2.0130 S 0 0 0 0 0 0 0 0 0 0 0 0 2.4190 -4.3450 -2.4840 C 0 0 0 0 0 0 0 0 0 0 0 0 3.1140 -3.1550 -1.8760 C 0 0 0 0 0 0 0 0 0 0 0 0 3.6890 -3.2560 -0.6230 C 0 0 0 0 0 0 0 0 0 0 0 0 4.3260 -2.1630 -0.0650 C 0 0 0 0 0 0 0 0 0 0 0 0 4.3890 -0.9700 -0.7600 C 0 0 0 0 0 0 0 0 0 0 0 0 3.8140 -0.8690 -2.0140 C 0 0 0 0 0 0 0 0 0 0 0 0 3.1810 -1.9630 -2.5730 C 0 0 0 0 0 0 0 0 0 0 0 0 5.0710 0.2000 -0.1630 N 0 3 0 0 0 0 0 0 0 0 0 0 5.5770 0.1110 0.9420 O 0 0 0 0 0 0 0 0 0 0 0 0 5.1260 1.2510 -0.7750 O 0 5 0 0 0 0 0 0 0 0 0 0 -8.8910 -10.5600 -3.0470 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.5980 -9.6850 -1.5250 H 0 0 0 0 0 0 0 0 0 0 0 0 -9.6750 -8.9880 -2.7590 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.6740 -9.4480 -3.0720 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.9420 -9.6930 -5.1900 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.7260 -8.1210 -4.9010 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.9720 -8.2000 -5.1940 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.7500 -5.3610 -1.4130 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.4590 -4.5030 -1.1820 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.9840 -7.8890 -3.3680 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.2780 -8.7400 -3.5850 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.5960 -8.2960 -2.9600 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.9750 -7.3210 -4.4170 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5550 -8.6140 -3.7340 H 0 0 0 0 0 0 0 0 0 0 0 0 0.1760 -7.6390 -5.1890 H 0 0 0 0 0 0 0 0 0 0 0 0 2.8840 -5.2620 -2.1220 H 0 0 0 0 0 0 0 0 0 0 0 0 2.5030 -4.3000 -3.5700 H 0 0 0 0 0 0 0 0 0 0 0 0 3.6400 -4.1880 -0.0800 H 0 0 0 0 0 0 0 0 0 0 0 0 4.7750 -2.2420 0.9140 H 0 0 0 0 0 0 0 0 0 0 0 0 3.8630 0.0630 -2.5570 H 0 0 0 0 0 0 0 0 0 0 0 0 2.7350 -1.8850 -3.5540 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 29 1 0 0 0 0 1 30 1 0 0 0 0 1 31 1 0 0 0 0 2 3 1 0 0 0 0 2 4 1 0 0 0 0 2 32 1 0 0 0 0 3 33 1 0 0 0 0 3 34 1 0 0 0 0 3 35 1 0 0 0 0 4 5 1 0 0 0 0 5 6 1 0 0 0 0 5 10 2 0 0 0 0 6 7 2 0 0 0 0 6 36 1 0 0 0 0 7 8 1 0 0 0 0 7 37 1 0 0 0 0 8 9 2 0 0 0 0 8 11 1 0 0 0 0 9 10 1 0 0 0 0 9 38 1 0 0 0 0 10 39 1 0 0 0 0 11 12 2 0 0 0 0 11 13 1 0 0 0 0 13 14 1 0 0 0 0 13 17 1 0 0 0 0 14 15 1 0 0 0 0 14 40 1 0 0 0 0 14 41 1 0 0 0 0 15 16 1 0 0 0 0 15 42 1 0 0 0 0 15 43 1 0 0 0 0 16 17 2 0 0 0 0 17 18 1 0 0 0 0 18 19 1 0 0 0 0 19 20 1 0 0 0 0 19 44 1 0 0 0 0 19 45 1 0 0 0 0 20 21 1 0 0 0 0 20 25 2 0 0 0 0 21 22 2 0 0 0 0 21 46 1 0 0 0 0 22 23 1 0 0 0 0 22 47 1 0 0 0 0 23 24 2 0 0 0 0 23 26 1 0 0 0 0 24 25 1 0 0 0 0 24 48 1 0 0 0 0 25 49 1 0 0 0 0 26 27 2 0 0 0 0 26 28 1 0 0 0 0 M CHG 1 26 1 M CHG 1 28 -1 M END