IFLAB-ZINC04371020 MOE2007 3D CORINA 3.40 0006 02.08.2006 52 54 0 0 1 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 0.7070 -0.4900 -1.2380 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0740 -0.7020 -1.2170 C 0 0 0 0 0 0 0 0 0 0 0 0 2.7240 -1.1480 -2.3530 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0090 -1.3830 -3.5120 C 0 0 0 0 0 0 0 0 0 0 0 0 0.6390 -1.1710 -3.5350 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0120 -0.7290 -2.3920 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0660 -1.4010 -4.6740 O 0 0 0 0 0 0 0 0 0 0 0 0 0.6690 -1.8600 -5.8100 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.2870 -2.0620 -6.9880 C 0 0 3 0 0 0 0 0 0 0 0 0 -1.0920 -2.7330 -6.6920 H 0 0 0 0 0 0 0 0 0 0 0 0 0.4770 -2.6700 -8.1660 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.4600 -2.9740 -9.2510 N 0 0 0 0 0 0 0 0 0 0 0 0 -0.8300 -2.1270 -10.2870 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.7330 -2.8380 -11.0700 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.8820 -4.0430 -10.5180 N 0 0 0 0 0 0 0 0 0 0 0 0 -1.1300 -4.1410 -9.4410 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.0390 -5.2510 -8.6320 N 0 0 0 0 0 0 0 0 0 0 0 0 -1.7640 -6.3710 -8.9260 N 0 0 0 0 0 0 0 0 0 0 0 0 -2.2720 -2.2260 -12.1900 N 0 0 0 0 0 0 0 0 0 0 0 0 -1.9210 -0.9640 -12.5040 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.4050 -0.4420 -13.4900 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.0500 -0.2680 -11.7530 N 0 0 0 0 0 0 0 0 0 0 0 0 -0.4920 -0.8120 -10.6520 C 0 0 0 0 0 0 0 0 0 0 0 0 0.2960 -0.1700 -9.9800 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.7000 1.1020 -12.1380 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.2260 -2.9510 -13.0330 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.8360 -0.8010 -7.3770 O 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 2.6340 -0.5180 -0.3120 H 0 0 0 0 0 0 0 0 0 0 0 0 3.7910 -1.3120 -2.3340 H 0 0 0 0 0 0 0 0 0 0 0 0 2.5180 -1.7300 -4.3990 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0800 -0.5680 -2.4070 H 0 0 0 0 0 0 0 0 0 0 0 0 1.4240 -1.1200 -6.0780 H 0 0 0 0 0 0 0 0 0 0 0 0 1.1550 -2.8060 -5.5710 H 0 0 0 0 0 0 0 0 0 0 0 0 1.2250 -1.9600 -8.5200 H 0 0 0 0 0 0 0 0 0 0 0 0 0.9700 -3.5870 -7.8440 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.4600 -5.2380 -7.8540 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.5660 -6.6950 -9.8610 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.5950 -7.0980 -8.2480 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.2400 1.3740 -13.0450 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9730 1.7860 -11.3340 H 0 0 0 0 0 0 0 0 0 0 0 0 0.3720 1.1650 -12.3210 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.2390 -2.7730 -12.6720 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.1400 -2.6010 -14.0620 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.0070 -4.0180 -12.9930 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.1750 -0.1520 -7.6540 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 33 1 0 0 0 0 2 34 1 0 0 0 0 3 4 1 0 0 0 0 3 8 2 0 0 0 0 4 5 2 0 0 0 0 4 35 1 0 0 0 0 5 6 1 0 0 0 0 5 36 1 0 0 0 0 6 7 2 0 0 0 0 6 37 1 0 0 0 0 7 8 1 0 0 0 0 7 9 1 0 0 0 0 8 38 1 0 0 0 0 9 10 1 0 0 0 0 10 11 1 0 0 0 0 10 39 1 0 0 0 0 10 40 1 0 0 0 0 11 12 1 0 0 0 0 11 13 1 0 0 0 0 11 29 1 0 0 0 0 13 14 1 0 0 0 0 13 41 1 0 0 0 0 13 42 1 0 0 0 0 14 15 1 0 0 0 0 14 18 1 0 0 0 0 15 16 2 0 0 0 0 15 25 1 0 0 0 0 16 17 1 0 0 0 0 16 21 1 0 0 0 0 17 18 2 0 0 0 0 18 19 1 0 0 0 0 19 20 1 0 0 0 0 19 43 1 0 0 0 0 20 44 1 0 0 0 0 20 45 1 0 0 0 0 21 22 1 0 0 0 0 21 28 1 0 0 0 0 22 23 2 0 0 0 0 22 24 1 0 0 0 0 24 25 1 0 0 0 0 24 27 1 0 0 0 0 25 26 2 0 0 0 0 27 46 1 0 0 0 0 27 47 1 0 0 0 0 27 48 1 0 0 0 0 28 49 1 0 0 0 0 28 50 1 0 0 0 0 28 51 1 0 0 0 0 29 52 1 0 0 0 0 M END