OTAVA-ZINC05552891 MOE2007 3D CORINA 3.40 0006 02.08.2006 51 52 0 0 1 0 0 0 0 0999 V2000 -4.0070 1.2800 3.6650 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.2960 0.0050 3.2400 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.2140 -0.9000 2.4160 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.4910 -2.1790 1.9830 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.4030 -3.1750 1.2520 C 0 0 3 0 0 0 0 0 0 0 0 0 -5.3020 -3.3810 1.8450 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.5620 -4.4740 1.1120 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.8170 -4.5110 0.0860 O 0 0 0 0 0 0 0 0 0 0 0 0 -4.8140 -2.6840 -0.0660 N 0 0 0 0 0 0 0 0 0 0 0 0 -5.9810 -2.0060 -0.3200 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.7990 -1.6760 0.5320 O 0 0 0 0 0 0 0 0 0 0 0 0 -6.1520 -1.6990 -1.7870 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.5670 -1.2150 -2.0860 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.7600 -1.0390 -3.5290 N 0 0 0 0 0 0 0 0 0 0 0 0 -8.1520 -2.1390 -4.2830 C 0 0 0 0 0 0 0 0 0 0 0 0 -8.3900 -3.2510 -3.8310 O 0 0 0 0 0 0 0 0 0 0 0 0 -8.2420 -1.7810 -5.7130 C 0 0 0 0 0 0 0 0 0 0 0 0 -8.5200 -2.5680 -6.7550 C 0 0 0 0 0 0 0 0 0 0 0 0 -8.7770 -4.0100 -6.7600 C 0 0 0 0 0 0 0 0 0 0 0 0 -9.9380 -4.4930 -7.3770 C 0 0 0 0 0 0 0 0 0 0 0 0 -10.1850 -5.8670 -7.4510 C 0 0 0 0 0 0 0 0 0 0 0 0 -9.2760 -6.7830 -6.9100 C 0 0 0 0 0 0 0 0 0 0 0 0 -8.1020 -6.3020 -6.3180 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.8530 -4.9270 -6.2480 C 0 0 0 0 0 0 0 0 0 0 0 0 -9.5250 -8.2580 -7.0190 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.9170 -0.0940 -5.9100 S 0 0 0 0 0 0 0 0 0 0 0 0 -7.5680 0.1490 -4.2050 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.0790 1.6260 -3.6010 S 0 0 0 0 0 0 0 0 0 0 0 0 -3.3330 1.9120 4.2530 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.3360 1.8550 2.7930 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.8840 1.0550 4.2790 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.4070 0.2660 2.6550 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.9520 -0.5280 4.1340 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.1000 -1.1590 3.0070 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.5570 -0.3480 1.5330 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.6400 -1.9090 1.3430 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.0680 -2.6600 2.8750 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.1580 -2.9210 -0.8090 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.4140 -0.9410 -2.0710 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.9320 -2.6050 -2.3650 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.2970 -1.9470 -1.7200 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.7710 -0.2760 -1.5600 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.5710 -2.1260 -7.7480 H 0 0 0 0 0 0 0 0 0 0 0 0 -10.6630 -3.8050 -7.8070 H 0 0 0 0 0 0 0 0 0 0 0 0 -11.0930 -6.2180 -7.9370 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.3710 -6.9920 -5.9040 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.9300 -4.5860 -5.7840 H 0 0 0 0 0 0 0 0 0 0 0 0 -9.1000 -8.6410 -7.9520 H 0 0 0 0 0 0 0 0 0 0 0 0 -9.0730 -8.7940 -6.1780 H 0 0 0 0 0 0 0 0 0 0 0 0 -10.5980 -8.4750 -7.0030 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.7360 -5.3340 2.0190 O 0 5 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 32 1 0 0 0 0 2 33 1 0 0 0 0 3 4 1 0 0 0 0 3 34 1 0 0 0 0 3 35 1 0 0 0 0 4 5 1 0 0 0 0 4 36 1 0 0 0 0 4 37 1 0 0 0 0 5 6 1 0 0 0 0 5 7 1 0 0 0 0 5 9 1 0 0 0 0 7 8 2 0 0 0 0 7 51 1 0 0 0 0 9 10 1 0 0 0 0 9 38 1 0 0 0 0 10 11 2 0 0 0 0 10 12 1 0 0 0 0 12 13 1 0 0 0 0 12 39 1 0 0 0 0 12 40 1 0 0 0 0 13 14 1 0 0 0 0 13 41 1 0 0 0 0 13 42 1 0 0 0 0 14 15 1 0 0 0 0 14 27 1 0 0 0 0 15 16 2 0 0 0 0 15 17 1 0 0 0 0 17 18 2 0 0 0 0 17 26 1 0 0 0 0 18 19 1 0 0 0 0 18 43 1 0 0 0 0 19 20 1 0 0 0 0 19 24 2 0 0 0 0 20 21 2 0 0 0 0 20 44 1 0 0 0 0 21 22 1 0 0 0 0 21 45 1 0 0 0 0 22 23 2 0 0 0 0 22 25 1 0 0 0 0 23 24 1 0 0 0 0 23 46 1 0 0 0 0 24 47 1 0 0 0 0 25 48 1 0 0 0 0 25 49 1 0 0 0 0 25 50 1 0 0 0 0 26 27 1 0 0 0 0 27 28 2 0 0 0 0 M CHG 1 51 -1 M END