IFLAB-ZINC02677375 MOE2007 3D CORINA 3.40 0006 02.08.2006 39 40 0 0 1 0 0 0 0 0999 V2000 -0.0180 1.5030 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 1.0610 -0.5960 -0.0110 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.2570 -0.7540 0.0100 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.2380 -2.1570 0.0020 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.4100 -2.8530 0.0100 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.6320 -2.1690 0.0260 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.6520 -0.7680 0.0340 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.4810 -0.0700 0.0310 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.8030 -2.8660 0.0340 N 0 0 0 0 0 0 0 0 0 0 0 0 -5.7720 -2.5150 0.8510 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.9920 -3.1200 0.9640 N 0 0 0 0 0 0 0 0 0 0 0 0 -7.8840 -2.6690 1.8290 C 0 0 0 0 0 0 0 0 0 0 0 0 -8.9790 -3.1710 1.9680 O 0 0 0 0 0 0 0 0 0 0 0 0 -7.4220 -1.4740 2.6300 C 0 0 3 0 0 0 0 0 0 0 0 0 -8.0620 -0.6130 2.4390 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.7320 -1.1760 2.0110 S 0 0 0 0 0 0 0 0 0 0 0 0 -7.3960 -1.8040 4.1240 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.0500 -0.5630 4.9060 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.8460 0.4780 4.3280 O 0 0 0 0 0 0 0 0 0 0 0 0 -7.3130 -4.2760 0.1230 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.8990 -5.5410 0.8280 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.7730 -6.4970 1.0260 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0040 1.8800 0.0030 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5460 1.8640 -0.8730 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5290 1.8540 0.9070 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.2960 -2.6840 -0.0100 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.3960 -3.9330 0.0040 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.5950 -0.2410 0.0460 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.4960 1.0100 0.0410 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.3760 -2.1670 4.4330 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.6470 -2.5730 4.3130 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.3860 -4.3000 -0.0670 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.7780 -4.1960 -0.8230 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.8820 -5.6610 1.1720 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.4770 -7.4040 1.5310 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.7900 -6.3770 0.6820 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.9700 -0.6140 6.2450 O 0 0 0 0 0 0 0 0 0 0 0 0 -6.7450 0.2070 6.7030 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 24 1 0 0 0 0 1 25 1 0 0 0 0 1 26 1 0 0 0 0 2 3 2 0 0 0 0 2 4 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 27 1 0 0 0 0 6 7 1 0 0 0 0 6 28 1 0 0 0 0 7 8 2 0 0 0 0 7 10 1 0 0 0 0 8 9 1 0 0 0 0 8 29 1 0 0 0 0 9 30 1 0 0 0 0 10 11 2 0 0 0 0 11 12 1 0 0 0 0 11 17 1 0 0 0 0 12 13 1 0 0 0 0 12 21 1 0 0 0 0 13 14 2 0 0 0 0 13 15 1 0 0 0 0 15 16 1 0 0 0 0 15 17 1 0 0 0 0 15 18 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 38 1 0 0 0 0 21 22 1 0 0 0 0 21 33 1 0 0 0 0 21 34 1 0 0 0 0 22 23 2 0 0 0 0 22 35 1 0 0 0 0 23 36 1 0 0 0 0 23 37 1 0 0 0 0 38 39 1 0 0 0 0 M END