NCID-ZINC04365970 MOE2007 3D CORINA 3.40 0006 02.08.2006 49 51 0 0 1 0 0 0 0 0999 V2000 -0.0190 1.5260 0.0100 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0020 -0.0040 0.0020 C 0 0 0 0 0 0 0 0 0 0 0 0 0.6930 -0.4770 1.1600 O 0 0 0 0 0 0 0 0 0 0 0 0 0.9060 -2.0420 1.4760 P 0 0 0 0 0 0 0 0 0 0 0 0 -0.6920 -2.9560 1.1870 S 0 0 0 0 0 0 0 0 0 0 0 0 2.0460 -2.6350 0.5060 O 0 0 0 0 0 0 0 0 0 0 0 0 2.2540 -4.0360 0.3140 C 0 0 0 0 0 0 0 0 0 0 0 0 3.4100 -4.2510 -0.6640 C 0 0 0 0 0 0 0 0 0 0 0 0 1.3580 -2.2230 3.0100 O 0 0 0 0 0 0 0 0 0 0 0 0 1.3270 -3.4810 3.6870 C 0 0 0 0 0 0 0 0 0 0 0 0 1.8190 -3.2980 5.1240 C 0 0 3 0 0 0 0 0 0 0 0 0 2.8010 -2.8240 5.1310 H 0 0 0 0 0 0 0 0 0 0 0 0 1.8760 -4.6610 5.8500 C 0 0 3 0 0 0 0 0 0 0 0 0 2.8920 -5.0550 5.8450 H 0 0 0 0 0 0 0 0 0 0 0 0 1.4290 -4.3360 7.2930 C 0 0 3 0 0 0 0 0 0 0 0 0 2.2240 -4.5700 8.0010 H 0 0 0 0 0 0 0 0 0 0 0 0 1.1550 -2.8160 7.2680 C 0 0 3 0 0 0 0 0 0 0 0 0 2.0340 -2.2670 7.6060 H 0 0 0 0 0 0 0 0 0 0 0 0 0.8760 -2.5120 5.8840 O 0 0 0 0 0 0 0 0 0 0 0 0 0.0000 -2.4920 8.1080 N 0 0 0 0 0 0 0 0 0 0 0 0 -1.2900 -2.3550 7.6880 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.0580 -2.0650 8.6970 N 0 0 0 0 0 0 0 0 0 0 0 0 -1.3130 -1.9980 9.8270 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0150 -2.2770 9.4630 C 0 0 0 0 0 0 0 0 0 0 0 0 0.9550 -2.2800 10.4030 N 0 0 0 0 0 0 0 0 0 0 0 0 0.6490 -2.0290 11.6580 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.5840 -1.7640 12.0480 N 0 0 0 0 0 0 0 0 0 0 0 0 -1.5890 -1.7300 11.1780 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.8790 -1.4540 11.5960 N 0 0 0 0 0 0 0 0 0 0 0 0 0.2390 -5.0560 7.6230 O 0 0 0 0 0 0 0 0 0 0 0 0 0.9760 -5.5900 5.2420 O 0 0 0 0 0 0 0 0 0 0 0 0 1.0040 1.9030 0.0030 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5460 1.8870 -0.8730 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5290 1.8770 0.9070 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0200 -0.3810 0.0100 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5120 -0.3560 -0.8950 H 0 0 0 0 0 0 0 0 0 0 0 0 2.4950 -4.5010 1.2700 H 0 0 0 0 0 0 0 0 0 0 0 0 1.3470 -4.4850 -0.0910 H 0 0 0 0 0 0 0 0 0 0 0 0 3.5690 -5.3190 -0.8100 H 0 0 0 0 0 0 0 0 0 0 0 0 3.1700 -3.7850 -1.6190 H 0 0 0 0 0 0 0 0 0 0 0 0 4.3170 -3.8010 -0.2590 H 0 0 0 0 0 0 0 0 0 0 0 0 0.3050 -3.8620 3.6990 H 0 0 0 0 0 0 0 0 0 0 0 0 1.9730 -4.1890 3.1690 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.6240 -2.4690 6.6670 H 0 0 0 0 0 0 0 0 0 0 0 0 1.4370 -2.0390 12.3980 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.6050 -1.4440 10.9540 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.0560 -1.2710 12.5320 H 0 0 0 0 0 0 0 0 0 0 0 0 0.3410 -6.0180 7.5950 H 0 0 0 0 0 0 0 0 0 0 0 0 0.9710 -6.4630 5.6580 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 32 1 0 0 0 0 1 33 1 0 0 0 0 1 34 1 0 0 0 0 2 3 1 0 0 0 0 2 35 1 0 0 0 0 2 36 1 0 0 0 0 3 4 1 0 0 0 0 4 5 2 0 0 0 0 4 6 1 0 0 0 0 4 9 1 0 0 0 0 6 7 1 0 0 0 0 7 8 1 0 0 0 0 7 37 1 0 0 0 0 7 38 1 0 0 0 0 8 39 1 0 0 0 0 8 40 1 0 0 0 0 8 41 1 0 0 0 0 9 10 1 0 0 0 0 10 11 1 0 0 0 0 10 42 1 0 0 0 0 10 43 1 0 0 0 0 11 12 1 0 0 0 0 11 13 1 0 0 0 0 11 19 1 0 0 0 0 13 14 1 0 0 0 0 13 15 1 0 0 0 0 13 31 1 0 0 0 0 15 16 1 0 0 0 0 15 17 1 0 0 0 0 15 30 1 0 0 0 0 17 18 1 0 0 0 0 17 19 1 0 0 0 0 17 20 1 0 0 0 0 20 21 1 0 0 0 0 20 24 1 0 0 0 0 21 22 2 0 0 0 0 21 44 1 0 0 0 0 22 23 1 0 0 0 0 23 24 1 0 0 0 0 23 28 2 0 0 0 0 24 25 2 0 0 0 0 25 26 1 0 0 0 0 26 27 2 0 0 0 0 26 45 1 0 0 0 0 27 28 1 0 0 0 0 28 29 1 0 0 0 0 29 46 1 0 0 0 0 29 47 1 0 0 0 0 30 48 1 0 0 0 0 31 49 1 0 0 0 0 M END