IBS-ZINC04816198 MOE2007 3D CORINA 3.40 0006 02.08.2006 39 41 0 0 1 0 0 0 0 0999 V2000 -0.0570 1.4040 0.5370 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0120 0.0340 0.2690 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2450 -0.5940 0.0380 C 0 0 0 0 0 0 0 0 0 0 0 0 2.4280 0.1620 0.1080 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3490 1.5400 0.3670 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1120 2.1630 0.5760 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0980 3.6180 0.8650 C 0 0 0 0 0 0 0 0 0 0 0 0 2.1070 4.1360 1.3410 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.1680 4.4140 0.6150 C 0 0 0 0 0 0 0 0 0 0 0 0 0.1600 5.8420 0.1670 C 0 0 3 0 0 0 0 0 0 0 0 0 0.8290 6.3170 0.8970 H 0 0 0 0 0 0 0 0 0 0 0 0 0.8410 5.9040 -1.2070 C 0 0 0 0 0 0 0 0 0 0 0 0 0.6380 4.9110 -1.9640 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.0490 6.6580 0.1170 N 0 0 0 0 0 0 0 0 0 0 0 0 -1.3900 7.6310 1.0190 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.6110 8.0990 0.5920 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.0220 7.4410 -0.5380 N 0 0 0 0 0 0 0 0 0 0 0 0 -2.0560 6.5890 -0.8080 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7790 -0.4580 -0.1520 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7730 -1.9820 -0.0480 C 0 0 0 0 0 0 0 0 0 0 0 0 2.5950 -2.5640 -0.8180 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2750 -2.0810 -0.2190 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.0310 1.8460 0.7220 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9090 -0.5460 0.2410 H 0 0 0 0 0 0 0 0 0 0 0 0 3.2610 2.1340 0.3980 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.7910 3.9200 -0.1390 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.7370 4.4270 1.5530 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.7580 7.8980 1.8540 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.2150 8.8750 1.0410 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.0340 5.9050 -1.6460 H 0 0 0 0 0 0 0 0 0 0 0 0 4.0980 -0.1660 -1.1600 H 0 0 0 0 0 0 0 0 0 0 0 0 4.5150 -0.0600 0.5570 H 0 0 0 0 0 0 0 0 0 0 0 0 4.7150 -2.3810 -0.4390 H 0 0 0 0 0 0 0 0 0 0 0 0 3.7090 -2.2840 1.0060 H 0 0 0 0 0 0 0 0 0 0 0 0 2.6600 -2.2630 -1.8710 H 0 0 0 0 0 0 0 0 0 0 0 0 2.6300 -3.6590 -0.7940 H 0 0 0 0 0 0 0 0 0 0 0 0 1.1010 -2.5930 0.7360 H 0 0 0 0 0 0 0 0 0 0 0 0 0.4590 -2.3580 -0.8970 H 0 0 0 0 0 0 0 0 0 0 0 0 1.5220 6.9450 -1.4260 O 0 5 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 6 2 0 0 0 0 1 23 1 0 0 0 0 2 3 2 0 0 0 0 2 24 1 0 0 0 0 3 4 1 0 0 0 0 3 22 1 0 0 0 0 4 5 2 0 0 0 0 4 19 1 0 0 0 0 5 6 1 0 0 0 0 5 25 1 0 0 0 0 6 7 1 0 0 0 0 7 8 2 0 0 0 0 7 9 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 14 1 0 0 0 0 12 13 2 0 0 0 0 12 39 1 0 0 0 0 14 15 1 0 0 0 0 14 18 1 0 0 0 0 15 16 2 0 0 0 0 15 28 1 0 0 0 0 16 17 1 0 0 0 0 16 29 1 0 0 0 0 17 18 2 0 0 0 0 18 30 1 0 0 0 0 19 20 1 0 0 0 0 19 31 1 0 0 0 0 19 32 1 0 0 0 0 20 21 1 0 0 0 0 20 33 1 0 0 0 0 20 34 1 0 0 0 0 21 22 1 0 0 0 0 21 35 1 0 0 0 0 21 36 1 0 0 0 0 22 37 1 0 0 0 0 22 38 1 0 0 0 0 M CHG 1 39 -1 M END