IBS-ZINC06760508 MOE2007 3D CORINA 3.40 0006 02.08.2006 43 45 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 0.0230 -0.7550 1.1460 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0410 -2.4530 0.6740 S 0 0 0 0 0 0 0 0 0 0 0 0 0.0190 -2.0070 -0.9760 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0040 -0.7090 -1.0980 N 0 0 0 0 0 0 0 0 0 0 0 0 0.0200 -2.9590 -2.1050 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0010 -2.4870 -3.4190 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0020 -3.3780 -4.4700 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0220 -4.7450 -4.2230 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0410 -5.2190 -2.9170 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0460 -4.3340 -1.8610 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0220 -5.6200 -5.2610 O 0 0 0 0 0 0 0 0 0 0 0 0 0.0430 -7.0120 -4.9370 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0300 -0.2400 2.5180 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0170 0.9610 2.7170 O 0 0 0 0 0 0 0 0 0 0 0 0 0.0520 -1.0950 3.5590 N 0 0 0 0 0 0 0 0 0 0 0 0 0.0590 -0.5800 4.9300 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0840 -1.7510 5.9150 C 0 0 3 0 0 0 0 0 0 0 0 0 0.9710 -2.3600 5.7440 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0840 -1.2190 7.3610 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.1830 -1.8440 7.9950 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.4520 -3.0510 7.0610 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.0980 -2.5520 5.7510 O 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 -0.0150 -1.4240 -3.6110 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0120 -3.0140 -5.4860 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0560 -6.2830 -2.7300 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0660 -4.7040 -0.8460 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0410 -7.5990 -5.8550 H 0 0 0 0 0 0 0 0 0 0 0 0 0.9420 -7.2380 -4.3630 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.8380 -7.2600 -4.3450 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0620 -2.0520 3.4000 H 0 0 0 0 0 0 0 0 0 0 0 0 0.9430 0.0400 5.0810 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.8370 0.0180 5.0990 H 0 0 0 0 0 0 0 0 0 0 0 0 0.9780 -1.5500 7.8900 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0170 -0.1310 7.3680 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9840 -2.1770 9.0140 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.0160 -1.1410 7.9730 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.8170 -3.8950 7.3320 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.5040 -3.3340 7.0930 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 25 1 0 0 0 0 1 26 1 0 0 0 0 1 27 1 0 0 0 0 2 3 2 0 0 0 0 2 6 1 0 0 0 0 3 4 1 0 0 0 0 3 15 1 0 0 0 0 4 5 1 0 0 0 0 5 6 2 0 0 0 0 5 7 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 8 28 1 0 0 0 0 9 10 1 0 0 0 0 9 29 1 0 0 0 0 10 11 2 0 0 0 0 10 13 1 0 0 0 0 11 12 1 0 0 0 0 11 30 1 0 0 0 0 12 31 1 0 0 0 0 13 14 1 0 0 0 0 14 32 1 0 0 0 0 14 33 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 18 19 1 0 0 0 0 18 36 1 0 0 0 0 18 37 1 0 0 0 0 19 20 1 0 0 0 0 19 21 1 0 0 0 0 19 24 1 0 0 0 0 21 22 1 0 0 0 0 21 38 1 0 0 0 0 21 39 1 0 0 0 0 22 23 1 0 0 0 0 22 40 1 0 0 0 0 22 41 1 0 0 0 0 23 24 1 0 0 0 0 23 42 1 0 0 0 0 23 43 1 0 0 0 0 M END