IBS-ZINC02116138 MOE2007 3D CORINA 3.40 0006 02.08.2006 51 54 0 0 1 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 -0.7020 1.1950 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0420 -2.0840 1.1880 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0390 -2.7680 -0.0130 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0180 -2.0710 -1.2060 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0060 -0.6890 -1.1990 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0610 -4.2750 -0.0220 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.3130 -4.7830 -0.0100 N 0 0 0 0 0 0 0 0 0 0 0 0 -1.5470 -6.1460 -0.0150 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.6200 -7.0700 -0.0290 N 0 0 0 0 0 0 0 0 0 0 0 0 -1.2080 -8.2950 -0.0290 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.7170 -9.6200 -0.0400 C 0 0 0 0 0 0 0 0 0 0 0 0 0.4830 -9.8410 -0.0530 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.6080 -10.6360 -0.0360 N 0 0 0 0 0 0 0 0 0 0 0 0 -1.2940 -11.5530 -0.0430 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.9460 -10.3770 -0.0210 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.4150 -9.1490 -0.0110 N 0 0 0 0 0 0 0 0 0 0 0 0 -2.5910 -8.0940 -0.0140 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.7820 -6.7350 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 -4.0720 -6.0410 0.0230 C 0 0 3 0 0 0 0 0 0 0 0 0 -4.8670 -6.7300 0.3080 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.3710 -5.4160 -1.3570 C 0 0 3 0 0 0 0 0 0 0 0 0 -3.4460 -5.2390 -1.9050 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.0640 -4.0770 -1.0200 C 0 0 3 0 0 0 0 0 0 0 0 0 -4.4820 -3.2380 -1.4020 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.1020 -4.0520 0.5240 C 0 0 3 0 0 0 0 0 0 0 0 0 -6.0560 -4.4340 0.8870 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.0250 -4.9230 0.9360 O 0 0 0 0 0 0 0 0 0 0 0 0 -4.8680 -2.6300 1.0400 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.0220 -2.6070 2.4600 O 0 0 0 0 0 0 0 0 0 0 0 0 -6.3890 -4.0490 -1.5560 O 0 0 0 0 0 0 0 0 0 0 0 0 -5.2450 -6.2590 -2.1100 O 0 0 0 0 0 0 0 0 0 0 0 0 -3.8290 -11.4280 -0.0180 N 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 -0.1670 2.1340 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0590 -2.6290 2.1200 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0160 -2.6060 -2.1450 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0260 -0.1440 -2.1310 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5700 -4.6260 -0.9190 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5890 -4.6360 0.8610 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.0600 -4.1640 0.0010 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.8590 -2.3100 0.7780 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.5930 -1.9550 0.5850 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.8870 -1.7350 2.8560 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.8700 -3.2310 -1.3740 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.4660 -5.9140 -2.9860 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.4980 -12.3400 -0.0260 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.7840 -11.2600 -0.0070 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 35 1 0 0 0 0 1 36 1 0 0 0 0 1 37 1 0 0 0 0 2 3 1 0 0 0 0 2 7 2 0 0 0 0 3 4 2 0 0 0 0 3 38 1 0 0 0 0 4 5 1 0 0 0 0 4 39 1 0 0 0 0 5 6 2 0 0 0 0 5 8 1 0 0 0 0 6 7 1 0 0 0 0 6 40 1 0 0 0 0 7 41 1 0 0 0 0 8 9 1 0 0 0 0 8 42 1 0 0 0 0 8 43 1 0 0 0 0 9 10 1 0 0 0 0 9 44 1 0 0 0 0 10 11 2 0 0 0 0 10 20 1 0 0 0 0 11 12 1 0 0 0 0 12 13 1 0 0 0 0 12 19 2 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 17 1 0 0 0 0 17 18 2 0 0 0 0 17 34 1 0 0 0 0 18 19 1 0 0 0 0 19 20 1 0 0 0 0 20 21 1 0 0 0 0 21 22 1 0 0 0 0 21 23 1 0 0 0 0 21 29 1 0 0 0 0 23 24 1 0 0 0 0 23 25 1 0 0 0 0 23 33 1 0 0 0 0 25 26 1 0 0 0 0 25 27 1 0 0 0 0 25 32 1 0 0 0 0 27 28 1 0 0 0 0 27 29 1 0 0 0 0 27 30 1 0 0 0 0 30 31 1 0 0 0 0 30 45 1 0 0 0 0 30 46 1 0 0 0 0 31 47 1 0 0 0 0 32 48 1 0 0 0 0 33 49 1 0 0 0 0 34 50 1 0 0 0 0 34 51 1 0 0 0 0 M END