IBS-ZINC03984504 MOE2007 3D CORINA 3.40 0006 02.08.2006 51 54 0 0 1 0 0 0 0 0999 V2000 -0.1050 1.0700 0.5770 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.2390 1.4390 2.9680 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.1950 1.9540 4.0450 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.4920 3.4140 3.8140 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.0340 4.1500 4.8560 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.3280 5.4920 4.6910 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.0770 6.1070 3.4690 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.5320 5.3690 2.4280 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.2380 4.0200 2.6020 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.6370 3.2640 1.4460 C 0 0 3 0 0 0 0 0 0 0 0 0 0.4200 3.5180 1.3600 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.3570 3.6590 0.1550 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.8410 3.4580 0.3260 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.2680 2.9440 1.3320 O 0 0 0 0 0 0 0 0 0 0 0 0 -3.7910 3.8980 -0.7580 C 0 0 3 0 0 0 0 0 0 0 0 0 -3.3680 4.7500 -1.2910 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.1340 4.2940 -0.1360 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.1370 4.6040 -1.2480 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.4000 3.3450 -2.0750 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.1050 2.9130 -2.7700 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.0260 2.7560 -1.7220 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.3680 1.7450 -1.6560 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.2860 5.9660 1.2310 O 0 0 0 0 0 0 0 0 0 0 0 0 0.0020 6.5590 1.0550 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.4490 7.4190 3.5550 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.5470 7.6980 4.9640 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.8560 6.4180 5.5450 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.3410 0.0100 0.6730 H 0 0 0 0 0 0 0 0 0 0 0 0 0.9730 1.2100 0.6520 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.4530 1.4340 -0.3900 H 0 0 0 0 0 0 0 0 0 0 0 0 0.7450 1.8860 3.1080 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.1620 0.3540 3.0370 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.1240 1.3850 4.0060 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.7360 1.8290 5.0260 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.2290 3.6710 5.8050 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.1560 4.7070 -0.0670 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9980 3.0380 -0.6660 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.5090 3.4720 0.4740 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.9980 5.1770 0.4880 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.0720 4.9500 -0.8060 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.7330 5.3840 -1.8940 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.7450 2.5450 -1.4200 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.1630 3.5550 -2.8250 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.2620 1.9620 -3.2790 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.8080 3.6710 -3.4950 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0660 6.9990 0.0600 H 0 0 0 0 0 0 0 0 0 0 0 0 0.1510 7.3350 1.8050 H 0 0 0 0 0 0 0 0 0 0 0 0 0.7720 5.7950 1.1640 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.5980 8.0740 5.3470 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.3490 8.4100 5.1580 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.7720 1.8180 1.6500 N 0 0 0 0 0 0 0 0 0 0 0 0 1 28 1 0 0 0 0 1 29 1 0 0 0 0 1 30 1 0 0 0 0 1 51 1 0 0 0 0 2 3 1 0 0 0 0 2 31 1 0 0 0 0 2 32 1 0 0 0 0 2 51 1 0 0 0 0 3 4 1 0 0 0 0 3 33 1 0 0 0 0 3 34 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 35 1 0 0 0 0 6 7 1 0 0 0 0 6 27 1 0 0 0 0 7 8 2 0 0 0 0 7 25 1 0 0 0 0 8 9 1 0 0 0 0 8 23 1 0 0 0 0 9 10 1 0 0 0 0 10 11 1 0 0 0 0 10 12 1 0 0 0 0 10 51 1 0 0 0 0 12 13 1 0 0 0 0 12 36 1 0 0 0 0 12 37 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 21 1 0 0 0 0 17 18 1 0 0 0 0 17 38 1 0 0 0 0 17 39 1 0 0 0 0 18 19 1 0 0 0 0 18 40 1 0 0 0 0 18 41 1 0 0 0 0 19 20 1 0 0 0 0 19 42 1 0 0 0 0 19 43 1 0 0 0 0 20 21 1 0 0 0 0 20 44 1 0 0 0 0 20 45 1 0 0 0 0 21 22 2 0 0 0 0 23 24 1 0 0 0 0 24 46 1 0 0 0 0 24 47 1 0 0 0 0 24 48 1 0 0 0 0 25 26 1 0 0 0 0 26 27 1 0 0 0 0 26 49 1 0 0 0 0 26 50 1 0 0 0 0 M END