OTAVA-ZINC04744797 MOE2007 3D CORINA 3.40 0006 02.08.2006 64 66 0 0 1 0 0 0 0 0999 V2000 -0.2290 0.9150 -0.8020 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0220 -0.4620 -0.1610 C 0 0 0 0 0 0 0 0 0 0 0 0 0.7220 -0.3890 1.1810 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.1450 0.1590 2.3170 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.3900 -0.7120 2.4940 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.2430 -0.8020 1.2170 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.2570 -1.9530 1.3500 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.0190 0.4890 0.9300 C 0 0 0 0 0 0 0 0 0 0 0 0 0.2100 0.9920 4.7280 C 0 0 0 0 0 0 0 0 0 0 0 0 0.9270 0.4490 5.9640 C 0 0 3 0 0 0 0 0 0 0 0 0 1.9840 0.7400 5.9550 H 0 0 0 0 0 0 0 0 0 0 0 0 0.2620 0.8840 7.2680 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0450 0.3330 8.3290 O 0 0 0 0 0 0 0 0 0 0 0 0 0.6260 0.5820 9.6070 C 0 0 0 0 0 0 0 0 0 0 0 0 1.4260 0.0220 10.6040 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1080 0.1950 11.9550 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0200 0.9360 12.3400 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.8140 1.4970 11.3260 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.4970 1.3230 9.9730 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.3610 1.1170 13.7610 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.5730 2.3990 14.2980 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.8970 2.5700 15.6460 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.0160 1.4620 16.4820 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.8100 0.1830 15.9700 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.4850 0.0130 14.6220 C 0 0 0 0 0 0 0 0 0 0 0 0 0.9010 -0.9900 5.8410 O 0 0 0 0 0 0 0 0 0 0 0 0 1.1890 -1.3360 6.7130 H 0 0 0 0 0 0 0 0 0 0 0 0 0.7730 -1.3370 -1.1480 C 0 0 0 0 0 0 0 0 0 0 0 0 0.7290 1.3270 -1.1420 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.8870 0.8560 -1.6760 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.6470 1.6500 -0.1130 H 0 0 0 0 0 0 0 0 0 0 0 0 1.0770 -1.3920 1.4580 H 0 0 0 0 0 0 0 0 0 0 0 0 1.6220 0.2300 1.0670 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.3990 1.2090 2.1400 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0770 -1.7220 2.7950 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.0110 -0.3330 3.3140 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.9390 -1.7810 2.1910 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.8650 -2.0560 0.4430 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.7570 -2.9130 1.5250 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.3960 1.3820 0.9780 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.4970 0.4600 -0.0550 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.8120 0.6320 1.6740 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.8720 0.8600 4.8100 H 0 0 0 0 0 0 0 0 0 0 0 0 0.4530 2.0350 4.5070 H 0 0 0 0 0 0 0 0 0 0 0 0 0.2480 1.9790 7.3320 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.7560 0.4770 7.3170 H 0 0 0 0 0 0 0 0 0 0 0 0 2.3070 -0.5540 10.3340 H 0 0 0 0 0 0 0 0 0 0 0 0 1.7580 -0.2470 12.7070 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.7030 2.0690 11.5850 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.1530 1.7790 9.2390 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.4750 3.2810 13.6680 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0540 3.5700 16.0430 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.2690 1.5950 17.5300 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9050 -0.6840 16.6180 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.3400 -0.9960 14.2420 H 0 0 0 0 0 0 0 0 0 0 0 0 1.7630 -0.9090 -1.3430 H 0 0 0 0 0 0 0 0 0 0 0 0 0.9250 -2.3500 -0.7570 H 0 0 0 0 0 0 0 0 0 0 0 0 0.2530 -1.4270 -2.1090 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.3560 -1.1510 0.0400 N 0 3 0 0 0 0 0 0 0 0 0 0 -1.9080 -1.0610 -0.8300 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.1680 -2.1650 0.0940 H 0 0 0 0 0 0 0 0 0 0 0 0 0.6760 0.1360 3.5740 N 0 3 0 0 0 0 0 0 0 0 0 0 0.7380 -0.8170 3.9980 H 0 0 0 0 0 0 0 0 0 0 0 0 1.6560 0.3840 3.3790 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 29 1 0 0 0 0 1 30 1 0 0 0 0 1 31 1 0 0 0 0 2 3 1 0 0 0 0 2 28 1 0 0 0 0 2 59 1 0 0 0 0 3 4 1 0 0 0 0 3 32 1 0 0 0 0 3 33 1 0 0 0 0 4 5 1 0 0 0 0 4 34 1 0 0 0 0 4 62 1 0 0 0 0 5 6 1 0 0 0 0 5 35 1 0 0 0 0 5 36 1 0 0 0 0 6 7 1 0 0 0 0 6 8 1 0 0 0 0 6 59 1 0 0 0 0 7 37 1 0 0 0 0 7 38 1 0 0 0 0 7 39 1 0 0 0 0 8 40 1 0 0 0 0 8 41 1 0 0 0 0 8 42 1 0 0 0 0 9 10 1 0 0 0 0 9 43 1 0 0 0 0 9 44 1 0 0 0 0 9 62 1 0 0 0 0 10 11 1 0 0 0 0 10 12 1 0 0 0 0 10 26 1 0 0 0 0 12 13 1 0 0 0 0 12 45 1 0 0 0 0 12 46 1 0 0 0 0 13 14 1 0 0 0 0 14 15 1 0 0 0 0 14 19 2 0 0 0 0 15 16 2 0 0 0 0 15 47 1 0 0 0 0 16 17 1 0 0 0 0 16 48 1 0 0 0 0 17 18 2 0 0 0 0 17 20 1 0 0 0 0 18 19 1 0 0 0 0 18 49 1 0 0 0 0 19 50 1 0 0 0 0 20 21 1 0 0 0 0 20 25 2 0 0 0 0 21 22 2 0 0 0 0 21 51 1 0 0 0 0 22 23 1 0 0 0 0 22 52 1 0 0 0 0 23 24 2 0 0 0 0 23 53 1 0 0 0 0 24 25 1 0 0 0 0 24 54 1 0 0 0 0 25 55 1 0 0 0 0 26 27 1 0 0 0 0 28 56 1 0 0 0 0 28 57 1 0 0 0 0 28 58 1 0 0 0 0 59 60 1 0 0 0 0 59 61 1 0 0 0 0 62 63 1 0 0 0 0 62 64 1 0 0 0 0 M CHG 1 59 1 M CHG 1 62 1 M END