IFLAB-ZINC02468185 MOE2007 3D CORINA 3.40 0006 02.08.2006 45 48 0 0 0 0 0 0 0 0999 V2000 -0.0180 1.5030 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 0.0230 -0.7010 1.1960 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0420 -2.0840 1.1920 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0400 -2.7730 -0.0050 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0180 -2.0760 -1.2050 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0060 -0.6880 -1.1980 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0160 -2.7720 -2.4220 N 0 0 0 0 0 0 0 0 0 0 0 0 0.8750 -3.7860 -2.7880 C 0 0 0 0 0 0 0 0 0 0 0 0 0.5240 -4.1690 -4.0280 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.5200 -3.4190 -4.4230 N 0 0 0 0 0 0 0 0 0 0 0 0 -0.8400 -2.5800 -3.4660 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.1480 -1.4010 -3.5230 S 0 0 0 0 0 0 0 0 0 0 0 0 -2.8060 -1.7410 -5.1750 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.9690 -0.8240 -5.4510 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.3190 -0.0190 -4.6140 O 0 0 0 0 0 0 0 0 0 0 0 0 -4.6200 -0.8970 -6.6290 N 0 0 0 0 0 0 0 0 0 0 0 0 -5.6890 -0.0540 -6.8830 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.3760 -0.0440 -7.9730 N 0 0 0 0 0 0 0 0 0 0 0 0 -7.3900 0.8370 -8.0720 C 0 0 0 0 0 0 0 0 0 0 0 0 -8.2800 1.0420 -9.1480 C 0 0 0 0 0 0 0 0 0 0 0 0 -9.2620 1.9960 -9.0650 C 0 0 0 0 0 0 0 0 0 0 0 0 -9.3960 2.7750 -7.9240 C 0 0 0 0 0 0 0 0 0 0 0 0 -8.5390 2.5930 -6.8620 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.5370 1.6280 -6.9280 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.3070 1.1500 -5.7600 S 0 0 0 0 0 0 0 0 0 0 0 0 0.0650 -2.8400 2.4960 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0040 1.8800 0.0030 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5460 1.8640 -0.8730 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5290 1.8540 0.9070 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0250 -0.1650 2.1330 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0550 -3.8530 -0.0070 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0260 -0.1430 -2.1300 H 0 0 0 0 0 0 0 0 0 0 0 0 1.6780 -4.1950 -2.1930 H 0 0 0 0 0 0 0 0 0 0 0 0 0.9990 -4.9460 -4.6080 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.0260 -1.5730 -5.9180 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.1400 -2.7770 -5.2270 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.3400 -1.5410 -7.2990 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.1880 0.4440 -10.0420 H 0 0 0 0 0 0 0 0 0 0 0 0 -9.9370 2.1430 -9.8950 H 0 0 0 0 0 0 0 0 0 0 0 0 -10.1720 3.5240 -7.8700 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.6450 3.2000 -5.9750 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9570 -3.0360 2.8200 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5900 -3.7850 2.3590 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5780 -2.2450 3.2520 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 7 2 0 0 0 0 3 4 2 0 0 0 0 3 31 1 0 0 0 0 4 5 1 0 0 0 0 4 27 1 0 0 0 0 5 6 2 0 0 0 0 5 32 1 0 0 0 0 6 7 1 0 0 0 0 6 8 1 0 0 0 0 7 33 1 0 0 0 0 8 9 1 0 0 0 0 8 12 1 0 0 0 0 9 10 2 0 0 0 0 9 34 1 0 0 0 0 10 11 1 0 0 0 0 10 35 1 0 0 0 0 11 12 2 0 0 0 0 12 13 1 0 0 0 0 13 14 1 0 0 0 0 14 15 1 0 0 0 0 14 36 1 0 0 0 0 14 37 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 38 1 0 0 0 0 18 19 2 0 0 0 0 18 26 1 0 0 0 0 19 20 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 39 1 0 0 0 0 22 23 1 0 0 0 0 22 40 1 0 0 0 0 23 24 2 0 0 0 0 23 41 1 0 0 0 0 24 25 1 0 0 0 0 24 42 1 0 0 0 0 25 26 1 0 0 0 0 27 43 1 0 0 0 0 27 44 1 0 0 0 0 27 45 1 0 0 0 0 M END