IFLAB-ZINC03911688 MOE2007 3D CORINA 3.40 0006 02.08.2006 45 47 0 0 0 0 0 0 0 0999 V2000 -0.0180 1.5030 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 0.0230 -0.6960 1.2110 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0420 -2.0580 1.2360 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0400 -2.7740 0.0290 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0580 -4.1830 0.0140 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0540 -4.8160 -1.1930 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0330 -4.0650 -2.3740 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0290 -4.7090 -3.5680 O 0 0 0 0 0 0 0 0 0 0 0 0 0.0150 -2.7500 -2.3550 N 0 0 0 0 0 0 0 0 0 0 0 0 -0.8550 -4.9080 -3.9050 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0180 -2.0730 -1.2010 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0060 -0.6680 -1.1860 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0740 -6.3220 -1.2560 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.3420 -6.8400 -1.5130 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.3230 -8.3040 -1.5740 N 0 0 0 0 0 0 0 0 0 0 0 0 -2.4660 -8.9840 -1.7920 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.5120 -8.3840 -1.9390 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.4460 -10.4590 -1.8540 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.6300 -11.1660 -2.0810 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.6070 -12.5420 -2.1380 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.4100 -13.2270 -1.9690 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.2300 -12.5270 -1.7430 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.2430 -11.1510 -1.6910 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.3920 -14.5830 -2.0250 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.1280 -15.2230 -1.8440 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0040 1.8800 0.0030 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5460 1.8640 -0.8730 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5290 1.8540 0.9070 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0250 -0.1460 2.1400 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0580 -2.5830 2.1790 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0750 -4.7470 0.9360 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0270 -0.1160 -2.1150 H 0 0 0 0 0 0 0 0 0 0 0 0 0.7310 -6.6430 -2.0640 H 0 0 0 0 0 0 0 0 0 0 0 0 0.4410 -6.7200 -0.3100 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.9990 -6.5190 -0.7040 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.7090 -6.4420 -2.4590 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.4880 -8.7830 -1.4570 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.5610 -10.6350 -2.2110 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.5220 -13.0890 -2.3130 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.3020 -13.0630 -1.6120 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.3260 -10.6080 -1.5200 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.2540 -16.3040 -1.9120 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.4360 -14.8890 -2.6180 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.7270 -14.9650 -0.8630 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 13 2 0 0 0 0 3 4 2 0 0 0 0 3 30 1 0 0 0 0 4 5 1 0 0 0 0 4 31 1 0 0 0 0 5 6 1 0 0 0 0 5 12 2 0 0 0 0 6 7 2 0 0 0 0 6 32 1 0 0 0 0 7 8 1 0 0 0 0 7 14 1 0 0 0 0 8 9 1 0 0 0 0 8 10 2 0 0 0 0 9 11 1 0 0 0 0 10 12 1 0 0 0 0 12 13 1 0 0 0 0 13 33 1 0 0 0 0 14 15 1 0 0 0 0 14 34 1 0 0 0 0 14 35 1 0 0 0 0 15 16 1 0 0 0 0 15 36 1 0 0 0 0 15 37 1 0 0 0 0 16 17 1 0 0 0 0 16 38 1 0 0 0 0 17 18 2 0 0 0 0 17 19 1 0 0 0 0 19 20 1 0 0 0 0 19 24 2 0 0 0 0 20 21 2 0 0 0 0 20 39 1 0 0 0 0 21 22 1 0 0 0 0 21 40 1 0 0 0 0 22 23 2 0 0 0 0 22 25 1 0 0 0 0 23 24 1 0 0 0 0 23 41 1 0 0 0 0 24 42 1 0 0 0 0 25 26 1 0 0 0 0 26 43 1 0 0 0 0 26 44 1 0 0 0 0 26 45 1 0 0 0 0 M END