IFLAB-ZINC04248880 MOE2007 3D CORINA 3.40 0006 02.08.2006 45 46 0 0 0 0 0 0 0 0999 V2000 0.0350 1.3890 -0.0480 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0480 -0.0400 -0.0470 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.2520 -0.6330 -0.0360 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.1180 -2.1570 -0.0360 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.4840 -2.5910 1.2120 N 0 0 0 0 0 0 0 0 0 0 0 0 -0.2620 -3.9010 1.4340 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.5880 -4.7210 0.6020 O 0 0 0 0 0 0 0 0 0 0 0 0 0.3900 -4.3480 2.7170 C 0 0 0 0 0 0 0 0 0 0 0 0 0.5490 -6.1510 2.7180 S 0 0 0 0 0 0 0 0 0 0 0 0 1.3190 -6.3900 4.2840 C 0 0 0 0 0 0 0 0 0 0 0 0 1.6240 -7.6540 4.6910 N 0 0 0 0 0 0 0 0 0 0 0 0 1.4170 -8.4090 4.1190 H 0 0 0 0 0 0 0 0 0 0 0 0 2.2140 -7.8570 5.8870 C 0 0 0 0 0 0 0 0 0 0 0 0 2.4920 -8.9870 6.2590 O 0 0 0 0 0 0 0 0 0 0 0 0 2.5040 -6.7480 6.6960 C 0 0 0 0 0 0 0 0 0 0 0 0 2.1700 -5.4800 6.2330 C 0 0 0 0 0 0 0 0 0 0 0 0 1.5910 -5.3430 5.0340 N 0 0 0 0 0 0 0 0 0 0 0 0 2.4420 -4.3650 7.0050 N 0 0 0 0 0 0 0 0 0 0 0 0 3.1180 -6.9160 7.9520 N 0 0 0 0 0 0 0 0 0 0 0 0 2.5200 -7.6630 8.9010 C 0 0 0 0 0 0 0 0 0 0 0 0 1.4930 -8.2610 8.6450 O 0 0 0 0 0 0 0 0 0 0 0 0 3.1120 -7.7540 10.2520 C 0 0 0 0 0 0 0 0 0 0 0 0 2.4950 -8.5260 11.2370 C 0 0 0 0 0 0 0 0 0 0 0 0 3.0530 -8.6080 12.4960 C 0 0 0 0 0 0 0 0 0 0 0 0 4.2220 -7.9260 12.7830 C 0 0 0 0 0 0 0 0 0 0 0 0 4.8390 -7.1580 11.8120 C 0 0 0 0 0 0 0 0 0 0 0 0 4.2940 -7.0730 10.5470 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0600 1.7620 -0.0560 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.4890 1.7470 -0.9340 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.4750 1.7490 0.8460 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.7890 -0.3150 0.8580 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.8030 -0.3170 -0.9220 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.1070 -2.6090 -0.1170 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5060 -2.4680 -0.8820 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.2240 -1.9350 1.8770 H 0 0 0 0 0 0 0 0 0 0 0 0 1.3790 -3.8960 2.7990 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.2220 -4.0370 3.5640 H 0 0 0 0 0 0 0 0 0 0 0 0 2.8650 -4.4660 7.8710 H 0 0 0 0 0 0 0 0 0 0 0 0 2.2080 -3.4810 6.6790 H 0 0 0 0 0 0 0 0 0 0 0 0 3.9730 -6.4940 8.1340 H 0 0 0 0 0 0 0 0 0 0 0 0 1.5820 -9.0590 11.0150 H 0 0 0 0 0 0 0 0 0 0 0 0 2.5760 -9.2050 13.2590 H 0 0 0 0 0 0 0 0 0 0 0 0 4.6550 -7.9920 13.7710 H 0 0 0 0 0 0 0 0 0 0 0 0 5.7510 -6.6270 12.0420 H 0 0 0 0 0 0 0 0 0 0 0 0 4.7790 -6.4770 9.7880 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 3 4 1 0 0 0 0 3 31 1 0 0 0 0 3 32 1 0 0 0 0 4 5 1 0 0 0 0 4 33 1 0 0 0 0 4 34 1 0 0 0 0 5 6 1 0 0 0 0 5 35 1 0 0 0 0 6 7 2 0 0 0 0 6 8 1 0 0 0 0 8 9 1 0 0 0 0 8 36 1 0 0 0 0 8 37 1 0 0 0 0 9 10 1 0 0 0 0 10 11 1 0 0 0 0 10 17 2 0 0 0 0 11 12 1 0 0 0 0 11 13 1 0 0 0 0 13 14 2 0 0 0 0 13 15 1 0 0 0 0 15 16 2 0 0 0 0 15 19 1 0 0 0 0 16 17 1 0 0 0 0 16 18 1 0 0 0 0 18 38 1 0 0 0 0 18 39 1 0 0 0 0 19 20 1 0 0 0 0 19 40 1 0 0 0 0 20 21 2 0 0 0 0 20 22 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 41 1 0 0 0 0 24 25 1 0 0 0 0 24 42 1 0 0 0 0 25 26 2 0 0 0 0 25 43 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 M END