IFLAB-ZINC04251308 MOE2007 3D CORINA 3.40 0006 02.08.2006 44 47 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 -0.7310 1.1210 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0410 -2.4330 0.6660 S 0 0 0 0 0 0 0 0 0 0 0 0 0.0200 -2.0020 -0.9880 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0040 -0.7120 -1.1120 N 0 0 0 0 0 0 0 0 0 0 0 0 0.0230 -2.9030 -2.0470 N 0 0 0 0 0 0 0 0 0 0 0 0 0.0430 -4.2280 -1.8030 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0590 -4.6340 -0.6600 O 0 0 0 0 0 0 0 0 0 0 0 0 0.0460 -5.2060 -2.9500 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0750 -6.8990 -2.3010 S 0 0 0 0 0 0 0 0 0 0 0 0 0.0750 -7.8840 -3.7620 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0950 -9.2770 -3.6670 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0940 -10.0080 -4.8410 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0730 -9.3060 -6.0520 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0550 -7.9800 -6.0450 N 0 0 0 0 0 0 0 0 0 0 0 0 0.0510 -7.3030 -4.9540 N 0 0 0 0 0 0 0 0 0 0 0 0 0.0710 -10.0420 -7.3380 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0500 -9.3420 -8.5440 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0490 -10.0300 -9.7390 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0680 -11.4190 -9.7430 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0890 -12.1190 -8.5430 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0960 -11.4360 -7.3450 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0670 -12.1150 -10.9590 N 0 0 0 0 0 0 0 0 0 0 0 0 0.0840 -13.4770 -11.1190 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0760 -13.7140 -12.4440 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0530 -12.5340 -13.0810 N 0 0 0 0 0 0 0 0 0 0 0 0 0.0420 -11.5680 -12.2020 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 0.0270 -0.3440 2.1290 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0100 -2.5780 -2.9600 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.8520 -5.0620 -3.5520 H 0 0 0 0 0 0 0 0 0 0 0 0 0.9280 -5.0380 -3.5680 H 0 0 0 0 0 0 0 0 0 0 0 0 0.1110 -9.7690 -2.7060 H 0 0 0 0 0 0 0 0 0 0 0 0 0.1090 -11.0880 -4.8240 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0340 -8.2620 -8.5420 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0330 -9.4880 -10.6730 H 0 0 0 0 0 0 0 0 0 0 0 0 0.1030 -13.1990 -8.5490 H 0 0 0 0 0 0 0 0 0 0 0 0 0.1170 -11.9810 -6.4130 H 0 0 0 0 0 0 0 0 0 0 0 0 0.1020 -14.2170 -10.3320 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0850 -14.6870 -12.9130 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0190 -10.5120 -12.4260 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 2 0 0 0 0 2 6 1 0 0 0 0 3 4 1 0 0 0 0 3 32 1 0 0 0 0 4 5 1 0 0 0 0 5 6 2 0 0 0 0 5 7 1 0 0 0 0 7 8 1 0 0 0 0 7 33 1 0 0 0 0 8 9 2 0 0 0 0 8 10 1 0 0 0 0 10 11 1 0 0 0 0 10 34 1 0 0 0 0 10 35 1 0 0 0 0 11 12 1 0 0 0 0 12 13 1 0 0 0 0 12 17 2 0 0 0 0 13 14 2 0 0 0 0 13 36 1 0 0 0 0 14 15 1 0 0 0 0 14 37 1 0 0 0 0 15 16 2 0 0 0 0 15 18 1 0 0 0 0 16 17 1 0 0 0 0 18 19 1 0 0 0 0 18 23 2 0 0 0 0 19 20 2 0 0 0 0 19 38 1 0 0 0 0 20 21 1 0 0 0 0 20 39 1 0 0 0 0 21 22 2 0 0 0 0 21 24 1 0 0 0 0 22 23 1 0 0 0 0 22 40 1 0 0 0 0 23 41 1 0 0 0 0 24 25 1 0 0 0 0 24 28 1 0 0 0 0 25 26 2 0 0 0 0 25 42 1 0 0 0 0 26 27 1 0 0 0 0 26 43 1 0 0 0 0 27 28 2 0 0 0 0 28 44 1 0 0 0 0 M END