IFLAB-ZINC03865404 MOE2007 3D CORINA 3.40 0006 02.08.2006 31 32 0 0 0 0 0 0 0 0999 V2000 -0.0180 1.4480 0.0100 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0020 -0.0040 0.0020 O 0 0 0 0 0 0 0 0 0 0 0 0 0.6000 -0.6020 -1.0460 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0920 0.0710 -1.9300 O 0 0 0 0 0 0 0 0 0 0 0 0 0.6580 -2.0760 -1.1220 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2780 -2.6990 -2.2070 C 0 0 0 0 0 0 0 0 0 0 0 0 1.3290 -4.0760 -2.2710 C 0 0 0 0 0 0 0 0 0 0 0 0 0.7680 -4.8400 -1.2630 C 0 0 0 0 0 0 0 0 0 0 0 0 0.1520 -4.2290 -0.1850 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0990 -2.8530 -0.1050 C 0 0 0 0 0 0 0 0 0 0 0 0 0.8270 -6.3440 -1.3400 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3360 -6.9300 -0.5320 S 0 0 0 0 0 0 0 0 0 0 0 0 2.1520 -8.6670 -0.7630 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0900 -9.1280 -1.3960 N 0 0 0 0 0 0 0 0 0 0 0 0 0.9140 -10.4320 -1.5920 C 0 0 0 0 0 0 0 0 0 0 0 0 1.8390 -11.3250 -1.1350 C 0 0 0 0 0 0 0 0 0 0 0 0 2.9740 -10.8430 -0.4600 C 0 0 0 0 0 0 0 0 0 0 0 0 3.1110 -9.5110 -0.2900 N 0 0 0 0 0 0 0 0 0 0 0 0 3.8210 -11.6140 -0.0390 O 0 0 0 0 0 0 0 0 0 0 0 0 1.0050 1.8250 0.0020 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5450 1.8090 -0.8730 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5280 1.7990 0.9070 H 0 0 0 0 0 0 0 0 0 0 0 0 1.7160 -2.1040 -2.9950 H 0 0 0 0 0 0 0 0 0 0 0 0 1.8080 -4.5590 -3.1100 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.2850 -4.8310 0.5980 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.3780 -2.3770 0.7390 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0420 -6.7680 -0.8380 H 0 0 0 0 0 0 0 0 0 0 0 0 0.8300 -6.6540 -2.3850 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0350 -10.7840 -2.1120 H 0 0 0 0 0 0 0 0 0 0 0 0 1.7020 -12.3850 -1.2910 H 0 0 0 0 0 0 0 0 0 0 0 0 3.8880 -9.1560 0.1700 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 20 1 0 0 0 0 1 21 1 0 0 0 0 1 22 1 0 0 0 0 2 3 1 0 0 0 0 3 4 2 0 0 0 0 3 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 23 1 0 0 0 0 7 8 1 0 0 0 0 7 24 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 25 1 0 0 0 0 10 26 1 0 0 0 0 11 12 1 0 0 0 0 11 27 1 0 0 0 0 11 28 1 0 0 0 0 12 13 1 0 0 0 0 13 14 2 0 0 0 0 13 18 1 0 0 0 0 14 15 1 0 0 0 0 15 16 2 0 0 0 0 15 29 1 0 0 0 0 16 17 1 0 0 0 0 16 30 1 0 0 0 0 17 18 1 0 0 0 0 17 19 2 0 0 0 0 18 31 1 0 0 0 0 M END