CHEMBRIDGE-ZINC00133500 MOE2007 3D CORINA 3.40 0006 02.08.2006 41 42 0 0 0 0 0 0 0 0999 V2000 -0.0300 1.5290 0.0090 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0000 -0.0010 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.7480 -0.5030 1.2370 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.4100 -0.5320 0.0160 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.2540 -0.2210 1.0650 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.5480 -0.7070 1.0800 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.0010 -1.5050 0.0460 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.1620 -1.8190 -1.0050 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.8640 -1.3270 -1.0250 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.0380 -1.6300 -2.0610 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.5730 -2.4540 -3.0990 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.5210 -2.6810 -4.1530 C 0 0 0 0 0 0 0 0 0 0 0 0 0.5790 -2.1850 -4.0280 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.8020 -3.4340 -5.2350 N 0 0 0 0 0 0 0 0 0 0 0 0 0.1410 -3.5660 -6.2600 C 0 0 0 0 0 0 0 0 0 0 0 0 1.4970 -3.6030 -5.9580 C 0 0 0 0 0 0 0 0 0 0 0 0 2.4250 -3.7320 -6.9730 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0060 -3.8250 -8.2880 C 0 0 0 0 0 0 0 0 0 0 0 0 0.6580 -3.7890 -8.5910 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.2760 -3.6650 -7.5810 C 0 0 0 0 0 0 0 0 0 0 0 0 0.2140 -3.8880 -10.0000 N 0 3 0 0 0 0 0 0 0 0 0 0 1.0370 -4.0020 -10.8910 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.9740 -3.8560 -10.2680 O 0 5 0 0 0 0 0 0 0 0 0 0 0.9900 1.9130 -0.0020 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5630 1.8870 -0.8720 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5390 1.8770 0.9080 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5090 -0.3490 -0.8990 H 0 0 0 0 0 0 0 0 0 0 0 0 0.2390 -0.1550 2.1360 H 0 0 0 0 0 0 0 0 0 0 0 0 0.7700 -1.5930 1.2300 H 0 0 0 0 0 0 0 0 0 0 0 0 1.7680 -0.1200 1.2250 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.9020 0.4020 1.8740 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.2060 -0.4640 1.9020 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.0130 -1.8840 0.0600 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.5160 -2.4420 -1.8130 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.8800 -3.4120 -2.6790 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.4360 -1.9600 -3.5460 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.6580 -3.8850 -5.3020 H 0 0 0 0 0 0 0 0 0 0 0 0 1.8240 -3.5300 -4.9320 H 0 0 0 0 0 0 0 0 0 0 0 0 3.4790 -3.7610 -6.7390 H 0 0 0 0 0 0 0 0 0 0 0 0 2.7340 -3.9260 -9.0790 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.3290 -3.6410 -7.8180 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 24 1 0 0 0 0 1 25 1 0 0 0 0 1 26 1 0 0 0 0 2 3 1 0 0 0 0 2 4 1 0 0 0 0 2 27 1 0 0 0 0 3 28 1 0 0 0 0 3 29 1 0 0 0 0 3 30 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 31 1 0 0 0 0 6 7 1 0 0 0 0 6 32 1 0 0 0 0 7 8 2 0 0 0 0 7 33 1 0 0 0 0 8 9 1 0 0 0 0 8 34 1 0 0 0 0 9 10 1 0 0 0 0 10 11 1 0 0 0 0 11 12 1 0 0 0 0 11 35 1 0 0 0 0 11 36 1 0 0 0 0 12 13 2 0 0 0 0 12 14 1 0 0 0 0 14 15 1 0 0 0 0 14 37 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 38 1 0 0 0 0 17 18 1 0 0 0 0 17 39 1 0 0 0 0 18 19 2 0 0 0 0 18 40 1 0 0 0 0 19 20 1 0 0 0 0 19 21 1 0 0 0 0 20 41 1 0 0 0 0 21 22 2 0 0 0 0 21 23 1 0 0 0 0 M CHG 1 21 1 M CHG 1 23 -1 M END