CHEMBRIDGE-ZINC04192490 MOE2007 3D CORINA 3.40 0006 02.08.2006 52 53 0 0 1 0 0 0 0 0999 V2000 1.1680 -0.4910 -0.7960 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0040 -0.0070 0.0300 C 0 0 0 0 0 0 0 0 0 0 0 0 0.1100 1.0020 0.6950 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.2580 -0.7580 0.0300 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.3410 -0.3100 0.7970 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.5180 -1.0140 0.7940 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.6370 -2.1720 0.0300 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.5630 -2.6200 -0.7340 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.3840 -1.9200 -0.7420 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.8340 -2.8840 0.0310 N 0 0 0 0 0 0 0 0 0 0 0 0 -6.0070 -2.2310 0.1470 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.0270 -1.0180 0.1540 O 0 0 0 0 0 0 0 0 0 0 0 0 -7.2930 -3.0070 0.2680 C 0 0 0 0 0 0 0 0 0 0 0 0 -8.4670 -2.0330 0.3850 C 0 0 3 0 0 0 0 0 0 0 0 0 -8.4530 -1.3440 -0.4590 H 0 0 0 0 0 0 0 0 0 0 0 0 -9.7620 -2.8040 0.3820 C 0 0 0 0 0 0 0 0 0 0 0 0 -10.5110 -2.7310 1.3270 O 0 0 0 0 0 0 0 0 0 0 0 0 -9.0470 0.0150 1.5400 C 0 0 0 0 0 0 0 0 0 0 0 0 -8.9040 0.7730 2.8610 C 0 0 0 0 0 0 0 0 0 0 0 0 -9.6180 2.0970 2.7600 C 0 0 0 0 0 0 0 0 0 0 0 0 -10.8350 2.1650 3.1950 C 0 0 0 0 0 0 0 0 0 0 0 0 -11.6740 3.4080 3.1520 C 0 0 0 0 0 0 0 0 0 0 0 0 -10.7870 4.6360 2.9370 C 0 0 0 0 0 0 0 0 0 0 0 0 -9.8510 4.3570 1.7540 C 0 0 0 0 0 0 0 0 0 0 0 0 -8.8710 3.2550 2.1660 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0100 0.1900 -0.6700 H 0 0 0 0 0 0 0 0 0 0 0 0 1.4560 -1.4900 -0.4690 H 0 0 0 0 0 0 0 0 0 0 0 0 0.8800 -0.5210 -1.8470 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.2500 0.5870 1.3900 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.3530 -0.6700 1.3850 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.6600 -3.5190 -1.3250 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5530 -2.2660 -1.3380 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.8230 -3.8510 -0.0520 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.4250 -3.6310 -0.6160 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.2540 -3.6380 1.1550 H 0 0 0 0 0 0 0 0 0 0 0 0 -10.1030 -0.1570 1.3310 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.6080 0.6030 0.7340 H 0 0 0 0 0 0 0 0 0 0 0 0 -9.3430 0.1850 3.6670 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.8480 0.9450 3.0690 H 0 0 0 0 0 0 0 0 0 0 0 0 -11.2740 1.2720 3.6140 H 0 0 0 0 0 0 0 0 0 0 0 0 -12.3910 3.3320 2.3340 H 0 0 0 0 0 0 0 0 0 0 0 0 -12.2130 3.5130 4.0940 H 0 0 0 0 0 0 0 0 0 0 0 0 -11.4100 5.5040 2.7150 H 0 0 0 0 0 0 0 0 0 0 0 0 -10.1980 4.8240 3.8340 H 0 0 0 0 0 0 0 0 0 0 0 0 -10.4360 4.0300 0.8940 H 0 0 0 0 0 0 0 0 0 0 0 0 -9.2990 5.2620 1.5020 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.1690 3.6480 2.9020 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.3190 2.9180 1.2880 H 0 0 0 0 0 0 0 0 0 0 0 0 -10.0820 -3.5740 -0.6700 O 0 0 0 0 0 0 0 0 0 0 0 0 -8.3510 -1.2760 1.6380 N 0 0 0 0 0 0 0 0 0 0 0 0 -8.6960 -1.8130 2.4190 H 0 0 0 0 0 0 0 0 0 0 0 0 -10.9230 -4.0490 -0.6260 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 26 1 0 0 0 0 1 27 1 0 0 0 0 1 28 1 0 0 0 0 2 3 2 0 0 0 0 2 4 1 0 0 0 0 4 5 1 0 0 0 0 4 9 2 0 0 0 0 5 6 2 0 0 0 0 5 29 1 0 0 0 0 6 7 1 0 0 0 0 6 30 1 0 0 0 0 7 8 2 0 0 0 0 7 10 1 0 0 0 0 8 9 1 0 0 0 0 8 31 1 0 0 0 0 9 32 1 0 0 0 0 10 11 1 0 0 0 0 10 33 1 0 0 0 0 11 12 2 0 0 0 0 11 13 1 0 0 0 0 13 14 1 0 0 0 0 13 34 1 0 0 0 0 13 35 1 0 0 0 0 14 15 1 0 0 0 0 14 16 1 0 0 0 0 14 50 1 0 0 0 0 16 17 2 0 0 0 0 16 49 1 0 0 0 0 18 19 1 0 0 0 0 18 36 1 0 0 0 0 18 37 1 0 0 0 0 18 50 1 0 0 0 0 19 20 1 0 0 0 0 19 38 1 0 0 0 0 19 39 1 0 0 0 0 20 21 2 0 0 0 0 20 25 1 0 0 0 0 21 22 1 0 0 0 0 21 40 1 0 0 0 0 22 23 1 0 0 0 0 22 41 1 0 0 0 0 22 42 1 0 0 0 0 23 24 1 0 0 0 0 23 43 1 0 0 0 0 23 44 1 0 0 0 0 24 25 1 0 0 0 0 24 45 1 0 0 0 0 24 46 1 0 0 0 0 25 47 1 0 0 0 0 25 48 1 0 0 0 0 49 52 1 0 0 0 0 50 51 1 0 0 0 0 M END