CHEMBRIDGE-ZINC04114989 MOE2007 3D CORINA 3.40 0006 02.08.2006 53 56 0 0 1 0 0 0 0 0999 V2000 1.0070 -0.8710 -1.2830 C 0 0 0 0 0 0 0 0 0 0 0 0 0.1470 -0.4770 -0.2120 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.0910 -1.0320 -0.1800 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.9770 -0.6910 0.8360 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.2330 -1.2520 0.8740 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.6190 -2.1670 -0.1130 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.7230 -2.5070 -1.1340 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.4710 -1.9370 -1.1660 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.9600 -2.7690 -0.0780 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.1050 -4.1040 -0.2220 O 0 0 0 0 0 0 0 0 0 0 0 0 -6.0720 -1.9690 0.1030 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.1030 -0.5680 0.1510 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.5130 -0.1410 0.3610 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.8860 1.0110 0.4490 O 0 0 0 0 0 0 0 0 0 0 0 0 -8.3130 -1.2180 0.4390 N 0 0 0 0 0 0 0 0 0 0 0 0 -7.5010 -2.4280 0.2820 C 0 0 3 0 0 0 0 0 0 0 0 0 -7.8260 -2.9860 -0.5960 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.6170 -3.2870 1.5140 C 0 0 0 0 0 0 0 0 0 0 0 0 -8.1680 -4.5510 1.4160 C 0 0 0 0 0 0 0 0 0 0 0 0 -8.2690 -5.3340 2.5550 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.8100 -4.8140 3.7560 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.2710 -3.5420 3.7770 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.1860 -2.8270 2.6720 N 0 0 0 0 0 0 0 0 0 0 0 0 -9.7640 -1.1870 0.6420 C 0 0 0 0 0 0 0 0 0 0 0 0 -10.4680 -1.1320 -0.7150 C 0 0 0 0 0 0 0 0 0 0 0 0 -11.9830 -1.1000 -0.5020 C 0 0 0 0 0 0 0 0 0 0 0 0 -12.6570 -1.0470 -1.8020 N 0 0 0 0 0 0 0 0 0 0 0 0 -13.0590 -2.1190 -2.5530 C 0 0 0 0 0 0 0 0 0 0 0 0 -13.6310 -1.6220 -3.6660 C 0 0 0 0 0 0 0 0 0 0 0 0 -13.5810 -0.2840 -3.5970 N 0 0 0 0 0 0 0 0 0 0 0 0 -13.0040 0.0680 -2.4800 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.1420 0.1720 0.0400 O 0 0 0 0 0 0 0 0 0 0 0 0 1.9620 -0.3540 -1.1910 H 0 0 0 0 0 0 0 0 0 0 0 0 1.1700 -1.9480 -1.2400 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5440 -0.6120 -2.2350 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.6790 0.0140 1.5980 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.9210 -0.9860 1.6640 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.0150 -3.2120 -1.8980 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.7800 -2.1950 -1.9550 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.5150 -4.9240 0.4640 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.6960 -6.3250 2.5090 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.8740 -5.3960 4.6640 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.9120 -3.1300 4.7080 H 0 0 0 0 0 0 0 0 0 0 0 0 -10.0750 -2.0840 1.1770 H 0 0 0 0 0 0 0 0 0 0 0 0 -10.0300 -0.3050 1.2260 H 0 0 0 0 0 0 0 0 0 0 0 0 -10.1570 -0.2340 -1.2500 H 0 0 0 0 0 0 0 0 0 0 0 0 -10.2020 -2.0130 -1.2980 H 0 0 0 0 0 0 0 0 0 0 0 0 -12.2940 -1.9970 0.0320 H 0 0 0 0 0 0 0 0 0 0 0 0 -12.2490 -0.2180 0.0810 H 0 0 0 0 0 0 0 0 0 0 0 0 -12.9390 -3.1620 -2.3010 H 0 0 0 0 0 0 0 0 0 0 0 0 -14.0570 -2.2000 -4.4730 H 0 0 0 0 0 0 0 0 0 0 0 0 -12.8300 1.0830 -2.1540 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.0260 -4.3980 -0.2600 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 3 4 1 0 0 0 0 3 8 2 0 0 0 0 4 5 2 0 0 0 0 4 36 1 0 0 0 0 5 6 1 0 0 0 0 5 37 1 0 0 0 0 6 7 2 0 0 0 0 6 9 1 0 0 0 0 7 8 1 0 0 0 0 7 38 1 0 0 0 0 8 39 1 0 0 0 0 9 10 1 0 0 0 0 9 11 2 0 0 0 0 10 53 1 0 0 0 0 11 12 1 0 0 0 0 11 16 1 0 0 0 0 12 13 1 0 0 0 0 12 32 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 24 1 0 0 0 0 16 17 1 0 0 0 0 16 18 1 0 0 0 0 18 19 1 0 0 0 0 18 23 2 0 0 0 0 19 20 2 0 0 0 0 19 40 1 0 0 0 0 20 21 1 0 0 0 0 20 41 1 0 0 0 0 21 22 2 0 0 0 0 21 42 1 0 0 0 0 22 23 1 0 0 0 0 22 43 1 0 0 0 0 24 25 1 0 0 0 0 24 44 1 0 0 0 0 24 45 1 0 0 0 0 25 26 1 0 0 0 0 25 46 1 0 0 0 0 25 47 1 0 0 0 0 26 27 1 0 0 0 0 26 48 1 0 0 0 0 26 49 1 0 0 0 0 27 28 1 0 0 0 0 27 31 1 0 0 0 0 28 29 2 0 0 0 0 28 50 1 0 0 0 0 29 30 1 0 0 0 0 29 51 1 0 0 0 0 30 31 2 0 0 0 0 31 52 1 0 0 0 0 M END