IBS-ZINC02130540 MOE2007 3D CORINA 3.40 0006 02.08.2006 54 58 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 -0.7020 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 -1.5410 -6.1120 -0.0150 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.6060 -6.8880 -0.0290 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.9280 -6.6250 -0.0030 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.1520 -7.9990 -0.0080 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.4640 -8.4660 0.0030 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.0840 -9.8010 0.0020 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.5770 -11.0980 -0.0100 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.4410 -12.1720 -0.0060 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.8120 -11.9650 0.0080 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.3280 -10.6870 0.0200 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.4720 -9.5900 0.0170 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.7060 -8.2270 0.0270 N 0 0 0 0 0 0 0 0 0 0 0 0 -7.5840 -7.8160 0.0380 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.5170 -7.5360 0.0180 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.2030 -6.1660 0.0230 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.9440 -5.7670 0.0170 N 0 0 0 0 0 0 0 0 0 0 0 0 -6.2930 -5.1620 0.0390 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.1310 -3.9650 0.7360 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.1490 -3.0330 0.7470 C 0 0 0 0 0 0 0 0 0 0 0 0 -8.3290 -3.2850 0.0700 C 0 0 0 0 0 0 0 0 0 0 0 0 -8.4950 -4.4710 -0.6230 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.4820 -5.4080 -0.6460 C 0 0 0 0 0 0 0 0 0 0 0 0 -9.4370 -2.2640 0.0870 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 -0.1670 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 -2.3220 -8.6900 -0.0210 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.5100 -11.2630 -0.0220 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.0490 -13.1780 -0.0160 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.4820 -12.8120 0.0110 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.3980 -10.5370 0.0310 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.2110 -3.7670 1.2650 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.0250 -2.1060 1.2860 H 0 0 0 0 0 0 0 0 0 0 0 0 -9.4180 -4.6620 -1.1500 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.6110 -6.3310 -1.1910 H 0 0 0 0 0 0 0 0 0 0 0 0 -9.3140 -1.5800 -0.7520 H 0 0 0 0 0 0 0 0 0 0 0 0 -10.3990 -2.7710 0.0040 H 0 0 0 0 0 0 0 0 0 0 0 0 -9.4010 -1.7040 1.0210 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 33 1 0 0 0 0 1 34 1 0 0 0 0 1 35 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 36 1 0 0 0 0 4 5 1 0 0 0 0 4 37 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 38 1 0 0 0 0 7 39 1 0 0 0 0 8 9 1 0 0 0 0 8 40 1 0 0 0 0 8 41 1 0 0 0 0 9 10 1 0 0 0 0 9 42 1 0 0 0 0 10 11 2 0 0 0 0 10 12 1 0 0 0 0 12 13 1 0 0 0 0 12 25 2 0 0 0 0 13 14 2 0 0 0 0 13 43 1 0 0 0 0 14 15 1 0 0 0 0 14 23 1 0 0 0 0 15 16 1 0 0 0 0 15 20 2 0 0 0 0 16 17 2 0 0 0 0 16 44 1 0 0 0 0 17 18 1 0 0 0 0 17 45 1 0 0 0 0 18 19 2 0 0 0 0 18 46 1 0 0 0 0 19 20 1 0 0 0 0 19 47 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 23 24 2 0 0 0 0 24 25 1 0 0 0 0 24 26 1 0 0 0 0 26 27 1 0 0 0 0 26 31 2 0 0 0 0 27 28 2 0 0 0 0 27 48 1 0 0 0 0 28 29 1 0 0 0 0 28 49 1 0 0 0 0 29 30 2 0 0 0 0 29 32 1 0 0 0 0 30 31 1 0 0 0 0 30 50 1 0 0 0 0 31 51 1 0 0 0 0 32 52 1 0 0 0 0 32 53 1 0 0 0 0 32 54 1 0 0 0 0 M END