OTAVA-ZINC01891289 MOE2007 3D CORINA 3.40 0006 02.08.2006 52 56 0 0 0 0 0 0 0 0999 V2000 -0.0170 1.3790 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 1.2060 -0.6800 -0.0130 C 0 0 0 0 0 0 0 0 0 0 0 0 2.4000 0.0310 -0.0210 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3770 1.4200 -0.0130 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1700 2.0890 0.0020 C 0 0 0 0 0 0 0 0 0 0 0 0 3.6230 -0.6510 -0.0360 N 0 0 0 0 0 0 0 0 0 0 0 0 4.7580 -0.2470 -0.6790 C 0 0 0 0 0 0 0 0 0 0 0 0 5.7340 -1.2290 -0.4250 C 0 0 0 0 0 0 0 0 0 0 0 0 5.1290 -2.2150 0.3850 C 0 0 0 0 0 0 0 0 0 0 0 0 3.8950 -1.8630 0.6120 N 0 0 0 0 0 0 0 0 0 0 0 0 7.0170 -1.0550 -0.9810 C 0 0 0 0 0 0 0 0 0 0 0 0 7.2430 0.0290 -1.7180 N 0 0 0 0 0 0 0 0 0 0 0 0 6.2950 0.9230 -1.9280 C 0 0 0 0 0 0 0 0 0 0 0 0 5.0830 0.8040 -1.4300 N 0 0 0 0 0 0 0 0 0 0 0 0 8.2890 -2.2420 -0.7060 S 0 0 0 0 0 0 0 0 0 0 0 0 9.6380 -1.4800 -1.6430 C 0 0 0 0 0 0 0 0 0 0 0 0 10.8680 -2.3460 -1.5480 C 0 0 0 0 0 0 0 0 0 0 0 0 10.8350 -3.3770 -0.9100 O 0 0 0 0 0 0 0 0 0 0 0 0 12.0030 -1.9740 -2.1720 N 0 0 0 0 0 0 0 0 0 0 0 0 13.1340 -2.7720 -2.0840 C 0 0 0 0 0 0 0 0 0 0 0 0 14.3320 -2.4870 -2.6780 C 0 0 0 0 0 0 0 0 0 0 0 0 15.3520 -3.4900 -2.4260 C 0 0 0 0 0 0 0 0 0 0 0 0 14.9030 -4.4910 -1.6600 C 0 0 0 0 0 0 0 0 0 0 0 0 13.2230 -4.2340 -1.2180 S 0 0 0 0 0 0 0 0 0 0 0 0 15.7410 -5.6800 -1.2300 C 0 0 0 0 0 0 0 0 0 0 0 0 16.9800 -5.7580 -2.1270 C 0 0 0 0 0 0 0 0 0 0 0 0 17.6520 -4.3820 -2.1710 C 0 0 0 0 0 0 0 0 0 0 0 0 16.7700 -3.4180 -2.9680 C 0 0 0 0 0 0 0 0 0 0 0 0 14.5650 -1.2880 -3.4880 C 0 0 0 0 0 0 0 0 0 0 0 0 14.9650 -0.2660 -2.9620 O 0 0 0 0 0 0 0 0 0 0 0 0 14.3370 -1.3180 -4.8160 N 0 0 0 0 0 0 0 0 0 0 0 0 -0.9600 1.9050 0.0170 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9260 -0.5560 0.0080 H 0 0 0 0 0 0 0 0 0 0 0 0 1.2200 -1.7600 -0.0190 H 0 0 0 0 0 0 0 0 0 0 0 0 3.3040 1.9750 -0.0190 H 0 0 0 0 0 0 0 0 0 0 0 0 1.1520 3.1690 0.0080 H 0 0 0 0 0 0 0 0 0 0 0 0 5.6100 -3.1070 0.7570 H 0 0 0 0 0 0 0 0 0 0 0 0 6.5230 1.7880 -2.5330 H 0 0 0 0 0 0 0 0 0 0 0 0 9.3440 -1.3800 -2.6870 H 0 0 0 0 0 0 0 0 0 0 0 0 9.8550 -0.4940 -1.2300 H 0 0 0 0 0 0 0 0 0 0 0 0 12.0290 -1.1500 -2.6820 H 0 0 0 0 0 0 0 0 0 0 0 0 16.0480 -5.5550 -0.1920 H 0 0 0 0 0 0 0 0 0 0 0 0 15.1570 -6.5950 -1.3340 H 0 0 0 0 0 0 0 0 0 0 0 0 17.6780 -6.4910 -1.7220 H 0 0 0 0 0 0 0 0 0 0 0 0 16.6840 -6.0520 -3.1340 H 0 0 0 0 0 0 0 0 0 0 0 0 17.7780 -4.0060 -1.1560 H 0 0 0 0 0 0 0 0 0 0 0 0 18.6260 -4.4680 -2.6530 H 0 0 0 0 0 0 0 0 0 0 0 0 16.7740 -3.7040 -4.0200 H 0 0 0 0 0 0 0 0 0 0 0 0 17.1510 -2.4020 -2.8620 H 0 0 0 0 0 0 0 0 0 0 0 0 14.0190 -2.1320 -5.2360 H 0 0 0 0 0 0 0 0 0 0 0 0 14.4910 -0.5240 -5.3530 H 0 0 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 33 1 0 0 0 0 2 3 2 0 0 0 0 2 34 1 0 0 0 0 3 4 1 0 0 0 0 3 35 1 0 0 0 0 4 5 2 0 0 0 0 4 7 1 0 0 0 0 5 6 1 0 0 0 0 5 36 1 0 0 0 0 6 37 1 0 0 0 0 7 8 1 0 0 0 0 7 11 1 0 0 0 0 8 9 1 0 0 0 0 8 15 2 0 0 0 0 9 10 1 0 0 0 0 9 12 2 0 0 0 0 10 11 2 0 0 0 0 10 38 1 0 0 0 0 12 13 1 0 0 0 0 12 16 1 0 0 0 0 13 14 2 0 0 0 0 14 15 1 0 0 0 0 14 39 1 0 0 0 0 16 17 1 0 0 0 0 17 18 1 0 0 0 0 17 40 1 0 0 0 0 17 41 1 0 0 0 0 18 19 2 0 0 0 0 18 20 1 0 0 0 0 20 21 1 0 0 0 0 20 42 1 0 0 0 0 21 22 2 0 0 0 0 21 25 1 0 0 0 0 22 23 1 0 0 0 0 22 30 1 0 0 0 0 23 24 2 0 0 0 0 23 29 1 0 0 0 0 24 25 1 0 0 0 0 24 26 1 0 0 0 0 26 27 1 0 0 0 0 26 43 1 0 0 0 0 26 44 1 0 0 0 0 27 28 1 0 0 0 0 27 45 1 0 0 0 0 27 46 1 0 0 0 0 28 29 1 0 0 0 0 28 47 1 0 0 0 0 28 48 1 0 0 0 0 29 49 1 0 0 0 0 29 50 1 0 0 0 0 30 31 2 0 0 0 0 30 32 1 0 0 0 0 32 51 1 0 0 0 0 32 52 1 0 0 0 0 M END