IFLAB-ZINC04478833 MOE2007 3D CORINA 3.40 0006 02.08.2006 48 51 0 0 1 0 0 0 0 0999 V2000 0.0280 1.4620 0.0240 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0290 -0.0450 0.0100 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0400 -0.7370 1.1950 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0400 -2.1240 1.2030 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0300 -2.8180 0.0140 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0180 -2.1330 -1.1980 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0120 -0.7340 -1.2200 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0050 -0.2300 -2.4700 N 0 0 0 0 0 0 0 0 0 0 0 0 -0.0180 -1.0600 -3.4550 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0050 -2.7150 -2.8610 S 0 0 0 0 0 0 0 0 0 0 0 0 -0.0370 -0.7000 -4.7920 N 0 0 0 0 0 0 0 0 0 0 0 0 -0.0500 -1.6520 -5.7460 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0450 -2.8270 -5.4330 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.0670 -1.3020 -7.0470 N 0 0 0 0 0 0 0 0 0 0 0 0 -0.0810 -2.3360 -8.0840 C 0 0 3 0 0 0 0 0 0 0 0 0 0.4970 -3.2060 -7.7730 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.5300 -2.7370 -8.4470 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.4860 -2.9760 -9.9400 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.3330 -3.5690 -10.5740 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.3720 -2.4340 -10.4630 N 0 0 0 0 0 0 0 0 0 0 0 0 0.4390 -1.7790 -9.4280 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0280 -2.4880 -11.8200 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0830 -1.7950 -12.2830 C 0 0 0 0 0 0 0 0 0 0 0 0 1.4220 -1.8490 -13.6200 C 0 0 0 0 0 0 0 0 0 0 0 0 0.6520 -2.5940 -14.5020 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.4580 -3.2860 -14.0400 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.7940 -3.2380 -12.7010 C 0 0 0 0 0 0 0 0 0 0 0 0 0.9860 -2.6460 -15.8190 O 0 0 0 0 0 0 0 0 0 0 0 0 0.1490 -3.4330 -16.6690 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0560 1.8260 0.0180 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.4930 1.8330 -0.8580 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.4780 1.8180 0.9220 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0480 -0.1970 2.1300 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0490 -2.6590 2.1410 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0300 -3.8980 0.0210 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0400 0.2370 -5.0420 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0710 -0.3640 -7.2970 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.8160 -3.6490 -7.9230 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.2200 -1.9270 -8.2110 H 0 0 0 0 0 0 0 0 0 0 0 0 0.2990 -0.6990 -9.4680 H 0 0 0 0 0 0 0 0 0 0 0 0 1.4910 -2.0300 -9.5580 H 0 0 0 0 0 0 0 0 0 0 0 0 1.6820 -1.2140 -11.5970 H 0 0 0 0 0 0 0 0 0 0 0 0 2.2860 -1.3100 -13.9800 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0570 -3.8660 -14.7270 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.6560 -3.7800 -12.3410 H 0 0 0 0 0 0 0 0 0 0 0 0 0.1520 -4.4670 -16.3250 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.8680 -3.0420 -16.6400 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5260 -3.3890 -17.6910 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 30 1 0 0 0 0 1 31 1 0 0 0 0 1 32 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 33 1 0 0 0 0 4 5 1 0 0 0 0 4 34 1 0 0 0 0 5 6 2 0 0 0 0 5 35 1 0 0 0 0 6 7 1 0 0 0 0 6 10 1 0 0 0 0 7 8 1 0 0 0 0 8 9 2 0 0 0 0 9 10 1 0 0 0 0 9 11 1 0 0 0 0 11 12 1 0 0 0 0 11 36 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 37 1 0 0 0 0 15 16 1 0 0 0 0 15 17 1 0 0 0 0 15 21 1 0 0 0 0 17 18 1 0 0 0 0 17 38 1 0 0 0 0 17 39 1 0 0 0 0 18 19 2 0 0 0 0 18 20 1 0 0 0 0 20 21 1 0 0 0 0 20 22 1 0 0 0 0 21 40 1 0 0 0 0 21 41 1 0 0 0 0 22 23 1 0 0 0 0 22 27 2 0 0 0 0 23 24 2 0 0 0 0 23 42 1 0 0 0 0 24 25 1 0 0 0 0 24 43 1 0 0 0 0 25 26 2 0 0 0 0 25 28 1 0 0 0 0 26 27 1 0 0 0 0 26 44 1 0 0 0 0 27 45 1 0 0 0 0 28 29 1 0 0 0 0 29 46 1 0 0 0 0 29 47 1 0 0 0 0 29 48 1 0 0 0 0 M END