NCID-ZINC01698167 MOE2007 3D CORINA 3.40 0006 02.08.2006 52 54 0 0 1 0 0 0 0 0999 V2000 0.0570 1.5660 0.3160 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0420 0.0940 -0.0800 C 0 0 3 0 0 0 0 0 0 0 0 0 0.3040 -0.0550 -1.1090 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.4930 -0.3570 -0.0020 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.3480 -0.2240 -1.0930 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.6460 -0.6140 -1.0650 N 0 0 0 0 0 0 0 0 0 0 0 0 -4.0840 -1.1480 0.0970 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.2340 -1.2690 1.1840 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.9370 -0.8790 1.1730 N 0 0 0 0 0 0 0 0 0 0 0 0 -3.7800 -1.8710 2.4040 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.1010 -2.2550 2.3220 N 0 0 0 0 0 0 0 0 0 0 0 0 -5.8760 -2.0990 1.2020 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.4210 -1.5670 0.1120 N 0 0 0 0 0 0 0 0 0 0 0 0 -7.1520 -2.5330 1.2850 N 0 0 0 0 0 0 0 0 0 0 0 0 -3.1160 -2.0290 3.4230 O 0 0 0 0 0 0 0 0 0 0 0 0 0.7440 -0.7250 0.8370 N 0 0 0 0 0 0 0 0 0 0 0 0 2.1040 -0.9410 0.8090 C 0 0 0 0 0 0 0 0 0 0 0 0 2.6810 -1.7580 1.7960 C 0 0 0 0 0 0 0 0 0 0 0 0 4.0590 -2.0020 1.8340 C 0 0 0 0 0 0 0 0 0 0 0 0 4.8900 -1.4140 0.8830 C 0 0 0 0 0 0 0 0 0 0 0 0 4.3340 -0.6210 -0.1230 C 0 0 0 0 0 0 0 0 0 0 0 0 2.9550 -0.3880 -0.1540 C 0 0 0 0 0 0 0 0 0 0 0 0 6.3480 -1.6580 0.9460 C 0 0 0 0 0 0 0 0 0 0 0 0 6.7710 -2.7380 1.3410 O 0 0 0 0 0 0 0 0 0 0 0 0 7.1220 -0.5910 0.5680 N 0 0 0 0 0 0 0 0 0 0 0 0 8.5800 -0.5970 0.3990 C 0 0 3 0 0 0 0 0 0 0 0 0 9.0160 -1.3320 1.0840 H 0 0 0 0 0 0 0 0 0 0 0 0 8.9690 -0.8990 -1.0580 C 0 0 0 0 0 0 0 0 0 0 0 0 8.5700 -2.3010 -1.5210 C 0 0 0 0 0 0 0 0 0 0 0 0 8.9810 -2.6620 -2.9510 C 0 0 0 0 0 0 0 0 0 0 0 0 9.3630 -1.7140 -3.6910 O 0 0 0 0 0 0 0 0 0 0 0 0 9.1430 0.8260 0.7050 C 0 0 0 0 0 0 0 0 0 0 0 0 8.2730 1.7510 0.6180 O 0 0 0 0 0 0 0 0 0 0 0 0 1.0890 1.9260 0.2620 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5490 2.1950 -0.3460 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.2940 1.7310 1.3420 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.0180 0.2000 -2.0360 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.5520 -2.9540 2.1100 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.7400 -2.4280 0.4680 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.4940 -2.6740 3.1520 H 0 0 0 0 0 0 0 0 0 0 0 0 0.1920 -1.1640 1.5730 H 0 0 0 0 0 0 0 0 0 0 0 0 2.0520 -2.2140 2.5570 H 0 0 0 0 0 0 0 0 0 0 0 0 4.4750 -2.6370 2.6120 H 0 0 0 0 0 0 0 0 0 0 0 0 4.9570 -0.1870 -0.9020 H 0 0 0 0 0 0 0 0 0 0 0 0 2.5660 0.2390 -0.9500 H 0 0 0 0 0 0 0 0 0 0 0 0 6.7260 0.3330 0.4020 H 0 0 0 0 0 0 0 0 0 0 0 0 8.5060 -0.1560 -1.7230 H 0 0 0 0 0 0 0 0 0 0 0 0 10.0540 -0.7820 -1.1810 H 0 0 0 0 0 0 0 0 0 0 0 0 9.0070 -3.0440 -0.8430 H 0 0 0 0 0 0 0 0 0 0 0 0 7.4810 -2.4160 -1.4800 H 0 0 0 0 0 0 0 0 0 0 0 0 8.8800 -3.8940 -3.2290 O 0 5 0 0 0 0 0 0 0 0 0 0 10.3630 0.8860 1.0250 O 0 5 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 34 1 0 0 0 0 1 35 1 0 0 0 0 1 36 1 0 0 0 0 2 3 1 0 0 0 0 2 4 1 0 0 0 0 2 16 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 37 1 0 0 0 0 6 7 1 0 0 0 0 7 8 2 0 0 0 0 7 13 1 0 0 0 0 8 9 1 0 0 0 0 8 10 1 0 0 0 0 10 11 1 0 0 0 0 10 15 2 0 0 0 0 11 12 1 0 0 0 0 11 40 1 0 0 0 0 12 13 2 0 0 0 0 12 14 1 0 0 0 0 14 38 1 0 0 0 0 14 39 1 0 0 0 0 16 17 1 0 0 0 0 16 41 1 0 0 0 0 17 18 1 0 0 0 0 17 22 2 0 0 0 0 18 19 2 0 0 0 0 18 42 1 0 0 0 0 19 20 1 0 0 0 0 19 43 1 0 0 0 0 20 21 2 0 0 0 0 20 23 1 0 0 0 0 21 22 1 0 0 0 0 21 44 1 0 0 0 0 22 45 1 0 0 0 0 23 24 2 0 0 0 0 23 25 1 0 0 0 0 25 26 1 0 0 0 0 25 46 1 0 0 0 0 26 27 1 0 0 0 0 26 28 1 0 0 0 0 26 32 1 0 0 0 0 28 29 1 0 0 0 0 28 47 1 0 0 0 0 28 48 1 0 0 0 0 29 30 1 0 0 0 0 29 49 1 0 0 0 0 29 50 1 0 0 0 0 30 31 2 0 0 0 0 30 51 1 0 0 0 0 32 33 2 0 0 0 0 32 52 1 0 0 0 0 M CHG 1 51 -1 M CHG 1 52 -1 M END