IBS-ZINC04000162 MOE2007 3D CORINA 3.40 0006 02.08.2006 53 56 0 0 1 0 0 0 0 0999 V2000 -0.0190 1.5230 0.0100 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0020 -0.0040 0.0020 C 0 0 3 0 0 0 0 0 0 0 0 0 0.7400 -0.5180 1.2380 C 0 0 0 0 0 0 0 0 0 0 0 0 2.1870 -0.0310 1.2610 C 0 0 0 0 0 0 0 0 0 0 0 0 2.9350 -0.5320 0.0220 C 0 0 0 0 0 0 0 0 0 0 0 0 2.1480 -0.1320 -1.2110 C 0 0 0 0 0 0 0 0 0 0 0 0 2.7210 0.5240 -2.1850 C 0 0 0 0 0 0 0 0 0 0 0 0 0.6920 -0.5390 -1.2580 C 0 0 3 0 0 0 0 0 0 0 0 0 0.6520 -1.6380 -1.2400 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0040 -0.0070 -2.4990 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.4890 -0.1580 -2.5210 C 0 0 3 0 0 0 0 0 0 0 0 0 -1.8690 0.6490 -3.1950 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.2180 0.0090 -1.1870 C 0 0 3 0 0 0 0 0 0 0 0 0 -2.4960 1.0660 -1.0160 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.4290 -0.5400 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.4210 -0.8220 -1.3140 O 0 0 0 0 0 0 0 0 0 0 0 0 -3.3260 -1.6910 -2.3270 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.1580 -2.5270 -2.6150 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.0240 -1.4780 -3.0800 C 0 0 3 0 0 0 0 0 0 0 0 0 -2.2390 -1.3710 -4.1530 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0850 -2.6600 -2.8660 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.7500 -5.0080 -3.3550 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.3410 -6.2030 -4.0570 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.0230 -6.4680 -5.3800 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.5910 -7.5790 -5.9860 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.4490 -8.3790 -5.2550 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.7280 -8.0970 -3.9980 N 0 0 0 0 0 0 0 0 0 0 0 0 -2.2020 -7.0520 -3.3880 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0040 1.9000 0.0030 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5460 1.8840 -0.8730 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5290 1.8740 0.9070 H 0 0 0 0 0 0 0 0 0 0 0 0 0.2250 -0.1610 2.1340 H 0 0 0 0 0 0 0 0 0 0 0 0 0.7250 -1.6100 1.2360 H 0 0 0 0 0 0 0 0 0 0 0 0 2.2330 1.0530 1.3100 H 0 0 0 0 0 0 0 0 0 0 0 0 2.6810 -0.4360 2.1530 H 0 0 0 0 0 0 0 0 0 0 0 0 3.9260 -0.0800 -0.0180 H 0 0 0 0 0 0 0 0 0 0 0 0 3.0250 -1.6170 0.0590 H 0 0 0 0 0 0 0 0 0 0 0 0 3.7660 0.7880 -2.1170 H 0 0 0 0 0 0 0 0 0 0 0 0 2.1490 0.8030 -3.0580 H 0 0 0 0 0 0 0 0 0 0 0 0 0.2340 1.0610 -2.6190 H 0 0 0 0 0 0 0 0 0 0 0 0 0.4240 -0.5020 -3.3840 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.4040 -1.6280 -0.0480 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.9190 -0.2380 0.9280 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.1050 -2.4260 -3.2820 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9880 -2.8600 -1.7990 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.6510 -5.2240 -2.2910 H 0 0 0 0 0 0 0 0 0 0 0 0 0.2320 -4.7900 -3.7740 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.3500 -5.8250 -5.9270 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.3660 -7.8150 -7.0150 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.8950 -9.2460 -5.7190 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.4520 -6.8550 -2.3560 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.6300 -3.8470 -3.5390 N 0 0 0 0 0 0 0 0 0 0 0 0 -2.5650 -4.0470 -3.2170 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 29 1 0 0 0 0 1 30 1 0 0 0 0 1 31 1 0 0 0 0 2 3 1 0 0 0 0 2 8 1 0 0 0 0 2 15 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 4 35 1 0 0 0 0 5 6 1 0 0 0 0 5 36 1 0 0 0 0 5 37 1 0 0 0 0 6 7 2 0 0 0 0 6 8 1 0 0 0 0 7 38 1 0 0 0 0 7 39 1 0 0 0 0 8 9 1 0 0 0 0 8 10 1 0 0 0 0 10 11 1 0 0 0 0 10 40 1 0 0 0 0 10 41 1 0 0 0 0 11 12 1 0 0 0 0 11 13 1 0 0 0 0 11 19 1 0 0 0 0 13 14 1 0 0 0 0 13 15 1 0 0 0 0 13 16 1 0 0 0 0 15 42 1 0 0 0 0 15 43 1 0 0 0 0 16 17 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 21 1 0 0 0 0 21 44 1 0 0 0 0 21 45 1 0 0 0 0 21 52 1 0 0 0 0 22 23 1 0 0 0 0 22 46 1 0 0 0 0 22 47 1 0 0 0 0 22 52 1 0 0 0 0 23 24 1 0 0 0 0 23 28 2 0 0 0 0 24 25 2 0 0 0 0 24 48 1 0 0 0 0 25 26 1 0 0 0 0 25 49 1 0 0 0 0 26 27 2 0 0 0 0 26 50 1 0 0 0 0 27 28 1 0 0 0 0 28 51 1 0 0 0 0 52 53 1 0 0 0 0 M END