NCID-ZINC04896842 MOE2007 3D CORINA 3.40 0006 02.08.2006 38 38 0 0 1 0 0 0 0 0999 V2000 -0.0190 1.5500 0.0110 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0020 -0.0040 0.0020 C 0 0 3 0 0 0 0 0 0 0 0 0 0.2290 -0.3770 1.0010 H 0 0 0 0 0 0 0 0 0 0 0 0 1.0550 -0.4250 -0.9410 N 0 0 0 0 0 0 0 0 0 0 0 0 2.3170 0.3080 -0.6860 C 0 0 3 0 0 0 0 0 0 0 0 0 1.7800 1.9230 -0.0050 S 0 0 0 0 0 0 0 0 0 0 0 0 2.2480 2.0530 1.3310 O 0 0 0 0 0 0 0 0 0 0 0 0 3.0910 0.5100 -1.9900 C 0 0 0 0 0 0 0 0 0 0 0 0 4.3880 1.2680 -1.7010 C 0 0 0 0 0 0 0 0 0 0 0 0 5.1630 1.4690 -3.0050 C 0 0 3 0 0 0 0 0 0 0 0 0 4.5230 1.9650 -3.7350 H 0 0 0 0 0 0 0 0 0 0 0 0 6.3780 2.3210 -2.7410 C 0 0 0 0 0 0 0 0 0 0 0 0 7.4620 1.8030 -2.6140 O 0 0 0 0 0 0 0 0 0 0 0 0 3.1170 -0.3940 0.2680 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.3350 -0.5320 -0.4500 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.4840 -0.9050 -1.5940 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.3650 -0.5890 0.4170 N 0 0 0 0 0 0 0 0 0 0 0 0 -3.6650 -1.1020 -0.0230 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.6370 -1.0600 1.1280 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.2800 -0.6450 2.2050 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.5090 1.9410 -0.8810 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.4920 1.9310 0.9160 H 0 0 0 0 0 0 0 0 0 0 0 0 0.7540 -0.3040 -1.8970 H 0 0 0 0 0 0 0 0 0 0 0 0 3.3270 -0.4610 -2.4260 H 0 0 0 0 0 0 0 0 0 0 0 0 2.4830 1.0840 -2.6890 H 0 0 0 0 0 0 0 0 0 0 0 0 4.1520 2.2390 -1.2650 H 0 0 0 0 0 0 0 0 0 0 0 0 4.9960 0.6940 -1.0020 H 0 0 0 0 0 0 0 0 0 0 0 0 6.1790 -0.3160 -2.8720 H 0 0 0 0 0 0 0 0 0 0 0 0 2.6850 -0.5260 1.1230 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.2460 -0.2900 1.3320 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.0420 -0.4860 -0.8390 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.5520 -2.1310 -0.3660 H 0 0 0 0 0 0 0 0 0 0 0 0 6.2550 3.6540 -2.6480 O 0 0 0 0 0 0 0 0 0 0 0 0 5.5840 0.1640 -3.5300 N 0 0 0 0 0 0 0 0 0 0 0 0 4.7860 -0.4020 -3.7760 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.8990 -1.4850 0.9570 O 0 0 0 0 0 0 0 0 0 0 0 0 -6.4850 -1.4390 1.7240 H 0 0 0 0 0 0 0 0 0 0 0 0 7.0620 4.1580 -2.4780 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 6 1 0 0 0 0 1 21 1 0 0 0 0 1 22 1 0 0 0 0 2 3 1 0 0 0 0 2 4 1 0 0 0 0 2 15 1 0 0 0 0 4 5 1 0 0 0 0 4 23 1 0 0 0 0 5 6 1 0 0 0 0 5 8 1 0 0 0 0 5 14 1 0 0 0 0 6 7 2 0 0 0 0 8 9 1 0 0 0 0 8 24 1 0 0 0 0 8 25 1 0 0 0 0 9 10 1 0 0 0 0 9 26 1 0 0 0 0 9 27 1 0 0 0 0 10 11 1 0 0 0 0 10 12 1 0 0 0 0 10 34 1 0 0 0 0 12 13 2 0 0 0 0 12 33 1 0 0 0 0 14 29 1 0 0 0 0 15 16 2 0 0 0 0 15 17 1 0 0 0 0 17 18 1 0 0 0 0 17 30 1 0 0 0 0 18 19 1 0 0 0 0 18 31 1 0 0 0 0 18 32 1 0 0 0 0 19 20 2 0 0 0 0 19 36 1 0 0 0 0 28 34 1 0 0 0 0 33 38 1 0 0 0 0 34 35 1 0 0 0 0 36 37 1 0 0 0 0 M END