IFLAB-ZINC04314867 MOE2007 3D CORINA 3.40 0006 02.08.2006 44 46 0 0 0 0 0 0 0 0999 V2000 -0.0190 1.5260 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 0.7180 -0.4980 -1.2570 C 0 0 0 0 0 0 0 0 0 0 0 0 0.7380 -1.9620 -1.2650 N 0 0 0 0 0 0 0 0 0 0 0 0 1.3330 -2.6370 -2.3060 C 0 0 0 0 0 0 0 0 0 0 0 0 1.9150 -2.0720 -3.3450 N 0 0 0 0 0 0 0 0 0 0 0 0 2.3890 -3.0100 -4.1670 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0870 -4.2480 -3.6090 C 0 0 0 0 0 0 0 0 0 0 0 0 1.4180 -3.9880 -2.4200 N 0 0 0 0 0 0 0 0 0 0 0 0 0.9020 -4.9800 -1.4740 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.5140 -5.3390 -1.8450 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.0400 -4.8190 -2.8060 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.2590 -6.3220 -1.0410 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.5730 -6.6580 -1.3830 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.2640 -7.5800 -0.6250 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.6600 -8.1710 0.4710 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.3610 -7.8440 0.8160 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.6540 -6.9290 0.0640 C 0 0 0 0 0 0 0 0 0 0 0 0 2.4800 -5.4180 -4.2820 C 0 0 0 0 0 0 0 0 0 0 0 0 2.2250 -6.5140 -3.8120 O 0 0 0 0 0 0 0 0 0 0 0 0 3.1410 -5.3160 -5.4540 N 0 0 0 0 0 0 0 0 0 0 0 0 3.4130 -6.1220 -5.9200 H 0 0 0 0 0 0 0 0 0 0 0 0 3.4280 -4.1150 -5.9840 C 0 0 0 0 0 0 0 0 0 0 0 0 4.0250 -4.0610 -7.0420 O 0 0 0 0 0 0 0 0 0 0 0 0 3.0700 -2.9700 -5.3730 N 0 0 0 0 0 0 0 0 0 0 0 0 3.4020 -1.6800 -5.9830 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0040 1.9030 0.0030 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5460 1.8870 -0.8730 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5290 1.8770 0.9070 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5290 -0.3650 0.8850 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0200 -0.3810 0.0100 H 0 0 0 0 0 0 0 0 0 0 0 0 0.1910 -0.1360 -2.1400 H 0 0 0 0 0 0 0 0 0 0 0 0 1.7410 -0.1200 -1.2640 H 0 0 0 0 0 0 0 0 0 0 0 0 0.3320 -2.4570 -0.5360 H 0 0 0 0 0 0 0 0 0 0 0 0 1.5240 -5.8740 -1.5080 H 0 0 0 0 0 0 0 0 0 0 0 0 0.9180 -4.5630 -0.4660 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.0450 -6.1970 -2.2380 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.2780 -7.8400 -0.8880 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.2070 -8.8920 1.0610 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.8970 -8.3100 1.6720 H 0 0 0 0 0 0 0 0 0 0 0 0 0.3620 -6.6780 0.3310 H 0 0 0 0 0 0 0 0 0 0 0 0 4.3780 -1.3510 -5.6290 H 0 0 0 0 0 0 0 0 0 0 0 0 3.4250 -1.7870 -7.0680 H 0 0 0 0 0 0 0 0 0 0 0 0 2.6480 -0.9430 -5.7070 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 27 1 0 0 0 0 1 28 1 0 0 0 0 1 29 1 0 0 0 0 2 3 1 0 0 0 0 2 30 1 0 0 0 0 2 31 1 0 0 0 0 3 4 1 0 0 0 0 3 32 1 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 9 1 0 0 0 0 6 7 1 0 0 0 0 7 8 2 0 0 0 0 7 25 1 0 0 0 0 8 9 1 0 0 0 0 8 19 1 0 0 0 0 9 10 1 0 0 0 0 10 11 1 0 0 0 0 10 35 1 0 0 0 0 10 36 1 0 0 0 0 11 12 2 0 0 0 0 11 13 1 0 0 0 0 13 14 1 0 0 0 0 13 18 2 0 0 0 0 14 15 2 0 0 0 0 14 37 1 0 0 0 0 15 16 1 0 0 0 0 15 38 1 0 0 0 0 16 17 2 0 0 0 0 16 39 1 0 0 0 0 17 18 1 0 0 0 0 17 40 1 0 0 0 0 18 41 1 0 0 0 0 19 20 2 0 0 0 0 19 21 1 0 0 0 0 21 22 1 0 0 0 0 21 23 1 0 0 0 0 23 24 2 0 0 0 0 23 25 1 0 0 0 0 25 26 1 0 0 0 0 26 42 1 0 0 0 0 26 43 1 0 0 0 0 26 44 1 0 0 0 0 M END