NCID-ZINC04946637 MOE2007 3D CORINA 3.40 0006 02.08.2006 53 56 0 0 1 0 0 0 0 0999 V2000 0.4440 1.0270 0.0050 C 0 0 0 0 0 0 0 0 0 0 0 0 0.1560 -0.4550 -0.1640 C 0 0 3 0 0 0 0 0 0 0 0 0 0.7830 -1.0670 0.4940 H 0 0 0 0 0 0 0 0 0 0 0 0 0.4490 -0.8400 -1.6550 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.5790 -1.2130 -2.3110 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.2520 -0.7490 0.0400 N 0 0 0 0 0 0 0 0 0 0 0 0 -1.9640 -0.7700 1.1970 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.2590 -1.0990 1.0540 N 0 0 0 0 0 0 0 0 0 0 0 0 -3.9310 -1.1330 2.2110 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.4290 -0.8850 3.4750 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.0770 -0.5440 3.5230 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.3560 -0.4930 2.3730 N 0 0 0 0 0 0 0 0 0 0 0 0 -1.3260 -0.1960 5.0860 S 0 0 0 0 0 0 0 0 0 0 0 0 0.2980 0.4160 4.5370 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1150 0.9090 5.7080 C 0 0 0 0 0 0 0 0 0 0 0 0 1.9390 0.0310 6.4260 C 0 0 0 0 0 0 0 0 0 0 0 0 2.6760 0.4870 7.5220 C 0 0 0 0 0 0 0 0 0 0 0 0 2.5950 1.8230 7.9110 C 0 0 0 0 0 0 0 0 0 0 0 0 1.7760 2.7050 7.2070 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0370 2.2510 6.1120 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.4140 -1.0460 4.4290 N 0 0 0 0 0 0 0 0 0 0 0 0 -5.4930 -1.3720 3.7450 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.2530 -1.4340 2.3980 N 0 0 0 0 0 0 0 0 0 0 0 0 -6.1950 -1.7690 1.3480 C 0 0 3 0 0 0 0 0 0 0 0 0 -5.6060 -2.0080 0.4540 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.3050 -0.7410 0.9520 C 0 0 3 0 0 0 0 0 0 0 0 0 -7.4420 -0.8740 -0.1330 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.5530 -1.3600 1.6000 C 0 0 3 0 0 0 0 0 0 0 0 0 -9.4840 -1.0920 1.0870 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.2680 -2.8480 1.5380 C 0 0 3 0 0 0 0 0 0 0 0 0 -8.4750 -3.2340 0.5320 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.8480 -3.0080 1.7350 O 0 0 0 0 0 0 0 0 0 0 0 0 -9.0010 -3.6810 2.5800 C 0 0 0 0 0 0 0 0 0 0 0 0 -8.7260 -5.0670 2.3550 O 0 0 0 0 0 0 0 0 0 0 0 0 -7.7550 -5.1130 2.2470 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.6500 -0.8810 2.9460 O 0 0 0 0 0 0 0 0 0 0 0 0 -8.1570 -0.0240 2.8330 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.1310 0.4750 1.4580 O 0 5 0 0 0 0 0 0 0 0 0 0 1.4990 1.2490 -0.1880 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.1540 1.6330 -0.6850 H 0 0 0 0 0 0 0 0 0 0 0 0 0.2160 1.3640 1.0220 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.7430 -0.9990 -0.8230 H 0 0 0 0 0 0 0 0 0 0 0 0 0.8410 -0.3840 4.0210 H 0 0 0 0 0 0 0 0 0 0 0 0 0.1650 1.2340 3.8190 H 0 0 0 0 0 0 0 0 0 0 0 0 2.0090 -1.0150 6.1350 H 0 0 0 0 0 0 0 0 0 0 0 0 3.3110 -0.2020 8.0730 H 0 0 0 0 0 0 0 0 0 0 0 0 3.1660 2.1770 8.7650 H 0 0 0 0 0 0 0 0 0 0 0 0 1.7070 3.7450 7.5120 H 0 0 0 0 0 0 0 0 0 0 0 0 0.3970 2.9460 5.5730 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.4690 -1.5740 4.1660 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.6650 -3.4480 3.5960 H 0 0 0 0 0 0 0 0 0 0 0 0 -10.0830 -3.5370 2.5170 H 0 0 0 0 0 0 0 0 0 0 0 0 1.6540 -0.7460 -2.0270 O 0 5 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 39 1 0 0 0 0 1 40 1 0 0 0 0 1 41 1 0 0 0 0 2 3 1 0 0 0 0 2 4 1 0 0 0 0 2 6 1 0 0 0 0 4 5 2 0 0 0 0 4 53 1 0 0 0 0 6 7 1 0 0 0 0 6 42 1 0 0 0 0 7 8 1 0 0 0 0 7 12 2 0 0 0 0 8 9 2 0 0 0 0 9 10 1 0 0 0 0 9 23 1 0 0 0 0 10 11 2 0 0 0 0 10 21 1 0 0 0 0 11 12 1 0 0 0 0 11 13 1 0 0 0 0 13 14 1 0 0 0 0 14 15 1 0 0 0 0 14 43 1 0 0 0 0 14 44 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 45 1 0 0 0 0 17 18 1 0 0 0 0 17 46 1 0 0 0 0 18 19 2 0 0 0 0 18 47 1 0 0 0 0 19 20 1 0 0 0 0 19 48 1 0 0 0 0 20 49 1 0 0 0 0 21 22 2 0 0 0 0 22 23 1 0 0 0 0 22 50 1 0 0 0 0 23 24 1 0 0 0 0 24 25 1 0 0 0 0 24 26 1 0 0 0 0 24 32 1 0 0 0 0 26 27 1 0 0 0 0 26 28 1 0 0 0 0 26 38 1 0 0 0 0 28 29 1 0 0 0 0 28 30 1 0 0 0 0 28 36 1 0 0 0 0 30 31 1 0 0 0 0 30 32 1 0 0 0 0 30 33 1 0 0 0 0 33 34 1 0 0 0 0 33 51 1 0 0 0 0 33 52 1 0 0 0 0 34 35 1 0 0 0 0 36 37 1 0 0 0 0 M CHG 1 38 -1 M CHG 1 53 -1 M END