NCID-ZINC05497203 MOE2007 3D CORINA 3.40 0006 02.08.2006 43 42 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 -1.3600 -0.5070 0.0120 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.5180 -1.8400 0.0070 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.5500 -2.5620 -0.0060 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.9020 -2.4340 0.0170 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.8060 -3.8960 0.0080 N 0 0 0 0 0 0 0 0 0 0 0 0 -3.9260 -4.6460 0.0150 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.0140 -4.1100 0.0280 O 0 0 0 0 0 0 0 0 0 0 0 0 -3.8270 -6.1490 0.0060 C 0 0 3 0 0 0 0 0 0 0 0 0 -3.2990 -6.4730 -0.8910 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.0620 -6.6170 1.2450 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.8140 -8.4120 1.1600 S 0 0 0 0 0 0 0 0 0 0 0 0 -5.1730 -6.7280 0.0150 N 0 0 0 0 0 0 0 0 0 0 0 0 -5.3790 -7.9630 -0.4830 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.4510 -8.5960 -0.9390 O 0 0 0 0 0 0 0 0 0 0 0 0 -6.7640 -8.5580 -0.4730 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.7220 -9.9570 -1.0900 C 0 0 0 0 0 0 0 0 0 0 0 0 -8.1280 -10.5610 -1.0800 C 0 0 3 0 0 0 0 0 0 0 0 0 -8.8180 -9.8840 -1.5840 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.1110 -11.8860 -1.7980 C 0 0 0 0 0 0 0 0 0 0 0 0 -8.0700 -12.9150 -1.1660 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 0.5120 -0.3560 -0.8950 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5290 -0.3650 0.8850 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.4310 -2.1110 0.9140 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.4480 -2.1010 -0.8660 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.9360 -4.3250 -0.0030 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.0940 -6.1180 1.2840 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.6340 -6.3720 2.1400 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.1400 -8.6780 2.2940 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.9160 -6.2220 0.3800 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.1230 -8.6240 0.5540 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.4360 -7.9250 -1.0520 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.3630 -9.8900 -2.1170 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.0500 -10.5900 -0.5100 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.9410 -11.3860 0.7970 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.1410 -11.9230 -3.1390 O 0 0 0 0 0 0 0 0 0 0 0 0 -8.5650 -10.7620 0.3080 N 0 0 0 0 0 0 0 0 0 0 0 0 -8.6460 -9.8800 0.7920 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.1280 -12.7960 -3.5550 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 23 1 0 0 0 0 1 24 1 0 0 0 0 1 25 1 0 0 0 0 2 3 1 0 0 0 0 2 26 1 0 0 0 0 2 27 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 6 7 1 0 0 0 0 6 28 1 0 0 0 0 6 29 1 0 0 0 0 7 8 1 0 0 0 0 7 30 1 0 0 0 0 8 9 2 0 0 0 0 8 10 1 0 0 0 0 10 11 1 0 0 0 0 10 12 1 0 0 0 0 10 14 1 0 0 0 0 12 13 1 0 0 0 0 12 31 1 0 0 0 0 12 32 1 0 0 0 0 13 33 1 0 0 0 0 14 15 1 0 0 0 0 14 34 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 35 1 0 0 0 0 17 36 1 0 0 0 0 18 19 1 0 0 0 0 18 37 1 0 0 0 0 18 38 1 0 0 0 0 19 20 1 0 0 0 0 19 21 1 0 0 0 0 19 41 1 0 0 0 0 21 22 2 0 0 0 0 21 40 1 0 0 0 0 39 41 1 0 0 0 0 40 43 1 0 0 0 0 41 42 1 0 0 0 0 M END