IFLAB-ZINC04275311 MOE2007 3D CORINA 3.40 0006 02.08.2006 51 54 0 0 0 0 0 0 0 0999 V2000 -0.0190 1.5360 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 0.7500 -0.4730 1.2550 C 0 0 0 0 0 0 0 0 0 0 0 0 0.8590 -1.9850 1.1490 C 0 0 0 0 0 0 0 0 0 0 0 0 0.9020 -2.9110 2.2590 C 0 0 0 0 0 0 0 0 0 0 0 0 0.9960 -4.2190 1.8660 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0390 -4.3370 0.1680 S 0 0 0 0 0 0 0 0 0 0 0 0 0.9320 -2.5970 -0.0410 C 0 0 0 0 0 0 0 0 0 0 0 0 0.9310 -1.8760 -1.3710 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3160 -2.0570 -2.0220 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.1130 -2.5140 -2.2980 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0500 -5.2980 2.7340 N 0 0 0 0 0 0 0 0 0 0 0 0 1.1420 -6.5520 2.2460 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1790 -6.7350 1.0450 O 0 0 0 0 0 0 0 0 0 0 0 0 1.1990 -7.7020 3.1710 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1560 -7.4830 4.5600 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2070 -8.5240 5.4300 C 0 0 0 0 0 0 0 0 0 0 0 0 1.3040 -9.8420 4.9470 C 0 0 0 0 0 0 0 0 0 0 0 0 1.3570 -10.9350 5.8280 C 0 0 0 0 0 0 0 0 0 0 0 0 1.4500 -12.1990 5.3310 C 0 0 0 0 0 0 0 0 0 0 0 0 1.4940 -12.4280 3.9570 C 0 0 0 0 0 0 0 0 0 0 0 0 1.4450 -11.3950 3.0720 C 0 0 0 0 0 0 0 0 0 0 0 0 1.3480 -10.0750 3.5490 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2890 -8.9880 2.6640 C 0 0 0 0 0 0 0 0 0 0 0 0 0.8550 -2.5130 3.6330 C 0 0 0 0 0 0 0 0 0 0 0 0 0.8170 -2.1970 4.7240 N 0 0 0 0 0 0 0 0 0 0 0 0 -1.4460 -0.4970 0.0600 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0040 1.9130 0.0030 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5460 1.8970 -0.8730 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5290 1.8880 0.9070 H 0 0 0 0 0 0 0 0 0 0 0 0 1.7420 -0.0260 1.2850 H 0 0 0 0 0 0 0 0 0 0 0 0 0.1840 -0.1950 2.1430 H 0 0 0 0 0 0 0 0 0 0 0 0 2.5100 -3.1190 -2.1730 H 0 0 0 0 0 0 0 0 0 0 0 0 2.3360 -1.5430 -2.9830 H 0 0 0 0 0 0 0 0 0 0 0 0 3.0820 -1.6370 -1.3690 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.1000 -2.4360 -1.8420 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.1140 -1.9940 -3.2560 H 0 0 0 0 0 0 0 0 0 0 0 0 0.1340 -3.5640 -2.4540 H 0 0 0 0 0 0 0 0 0 0 0 0 1.0200 -5.1520 3.6920 H 0 0 0 0 0 0 0 0 0 0 0 0 1.0820 -6.4750 4.9390 H 0 0 0 0 0 0 0 0 0 0 0 0 1.1730 -8.3400 6.4940 H 0 0 0 0 0 0 0 0 0 0 0 0 1.3240 -10.7730 6.8950 H 0 0 0 0 0 0 0 0 0 0 0 0 1.4910 -13.0360 6.0110 H 0 0 0 0 0 0 0 0 0 0 0 0 1.5690 -13.4410 3.5880 H 0 0 0 0 0 0 0 0 0 0 0 0 1.4800 -11.5880 2.0100 H 0 0 0 0 0 0 0 0 0 0 0 0 1.3170 -9.1520 1.5970 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.9920 -0.1230 -0.8060 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.4600 -1.5870 0.0550 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.9180 -0.1320 0.9720 H 0 0 0 0 0 0 0 0 0 0 0 0 0.6680 -0.4570 -1.2070 N 0 0 0 0 0 0 0 0 0 0 0 0 0.2800 -0.0390 -2.0390 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 27 1 0 0 0 0 2 50 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 8 2 0 0 0 0 5 6 2 0 0 0 0 5 25 1 0 0 0 0 6 7 1 0 0 0 0 6 12 1 0 0 0 0 7 8 1 0 0 0 0 8 9 1 0 0 0 0 9 10 1 0 0 0 0 9 11 1 0 0 0 0 9 50 1 0 0 0 0 10 33 1 0 0 0 0 10 34 1 0 0 0 0 10 35 1 0 0 0 0 11 36 1 0 0 0 0 11 37 1 0 0 0 0 11 38 1 0 0 0 0 12 13 1 0 0 0 0 12 39 1 0 0 0 0 13 14 2 0 0 0 0 13 15 1 0 0 0 0 15 16 1 0 0 0 0 15 24 2 0 0 0 0 16 17 2 0 0 0 0 16 40 1 0 0 0 0 17 18 1 0 0 0 0 17 41 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 42 1 0 0 0 0 20 21 1 0 0 0 0 20 43 1 0 0 0 0 21 22 2 0 0 0 0 21 44 1 0 0 0 0 22 23 1 0 0 0 0 22 45 1 0 0 0 0 23 24 1 0 0 0 0 24 46 1 0 0 0 0 25 26 3 0 0 0 0 27 47 1 0 0 0 0 27 48 1 0 0 0 0 27 49 1 0 0 0 0 50 51 1 0 0 0 0 M END