OTAVA-ZINC05414040 MOE2007 3D CORINA 3.40 0006 02.08.2006 44 47 0 0 1 0 0 0 0 0999 V2000 -0.0660 1.5200 0.0080 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0440 -0.0100 0.0010 C 0 0 3 0 0 0 0 0 0 0 0 0 -1.0660 -0.3900 0.0170 H 0 0 0 0 0 0 0 0 0 0 0 0 0.7110 -0.5180 1.2320 C 0 0 0 0 0 0 0 0 0 0 0 0 0.5090 -2.0290 1.3540 C 0 0 0 0 0 0 0 0 0 0 0 0 0.8390 -2.6820 0.0180 C 0 0 0 0 0 0 0 0 0 0 0 0 0.9070 -2.0010 -1.1320 C 0 0 0 0 0 0 0 0 0 0 0 0 1.3080 -3.0550 -2.4820 S 0 0 0 0 0 0 0 0 0 0 0 0 1.3860 -4.4620 -1.4540 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1080 -4.0960 -0.1300 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1200 -5.0970 0.8800 C 0 0 0 0 0 0 0 0 0 0 0 0 1.4020 -6.3320 0.4640 N 0 0 0 0 0 0 0 0 0 0 0 0 1.6560 -6.6240 -0.7960 C 0 0 0 0 0 0 0 0 0 0 0 0 1.6590 -5.7350 -1.7740 N 0 0 0 0 0 0 0 0 0 0 0 0 0.7830 -4.7290 2.5700 S 0 0 0 0 0 0 0 0 0 0 0 0 0.9540 -6.3810 3.2910 C 0 0 0 0 0 0 0 0 0 0 0 0 0.7020 -6.3100 4.7750 C 0 0 0 0 0 0 0 0 0 0 0 0 0.4340 -5.2470 5.2940 O 0 0 0 0 0 0 0 0 0 0 0 0 0.7760 -7.4270 5.5260 N 0 0 0 0 0 0 0 0 0 0 0 0 0.6350 -7.3460 6.9160 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.2300 -6.4150 7.4750 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.3670 -6.3380 8.8470 C 0 0 0 0 0 0 0 0 0 0 0 0 0.3550 -7.1880 9.6650 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2180 -8.1170 9.1120 C 0 0 0 0 0 0 0 0 0 0 0 0 1.3560 -8.2020 7.7400 C 0 0 0 0 0 0 0 0 0 0 0 0 2.4330 -9.3730 7.0460 Cl 0 0 0 0 0 0 0 0 0 0 0 0 0.6670 -0.5070 -1.2600 C 0 0 0 0 0 0 0 0 0 0 0 0 0.9570 1.8980 -0.0080 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.6000 1.8800 -0.8720 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5690 1.8720 0.9080 H 0 0 0 0 0 0 0 0 0 0 0 0 1.7740 -0.3000 1.1240 H 0 0 0 0 0 0 0 0 0 0 0 0 0.3260 -0.0260 2.1250 H 0 0 0 0 0 0 0 0 0 0 0 0 1.1700 -2.4240 2.1260 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5280 -2.2390 1.6170 H 0 0 0 0 0 0 0 0 0 0 0 0 1.8760 -7.6510 -1.0440 H 0 0 0 0 0 0 0 0 0 0 0 0 0.2310 -7.0540 2.8320 H 0 0 0 0 0 0 0 0 0 0 0 0 1.9630 -6.7530 3.1110 H 0 0 0 0 0 0 0 0 0 0 0 0 0.9260 -8.2860 5.1020 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.7940 -5.7510 6.8380 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0400 -5.6140 9.2820 H 0 0 0 0 0 0 0 0 0 0 0 0 0.2460 -7.1260 10.7380 H 0 0 0 0 0 0 0 0 0 0 0 0 1.7800 -8.7790 9.7540 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0450 -0.3080 -2.1320 H 0 0 0 0 0 0 0 0 0 0 0 0 1.6230 0.0070 -1.3660 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 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 2 3 1 0 0 0 0 2 4 1 0 0 0 0 2 27 1 0 0 0 0 4 5 1 0 0 0 0 4 31 1 0 0 0 0 4 32 1 0 0 0 0 5 6 1 0 0 0 0 5 33 1 0 0 0 0 5 34 1 0 0 0 0 6 7 2 0 0 0 0 6 10 1 0 0 0 0 7 8 1 0 0 0 0 7 27 1 0 0 0 0 8 9 1 0 0 0 0 9 10 1 0 0 0 0 9 14 2 0 0 0 0 10 11 2 0 0 0 0 11 12 1 0 0 0 0 11 15 1 0 0 0 0 12 13 2 0 0 0 0 13 14 1 0 0 0 0 13 35 1 0 0 0 0 15 16 1 0 0 0 0 16 17 1 0 0 0 0 16 36 1 0 0 0 0 16 37 1 0 0 0 0 17 18 2 0 0 0 0 17 19 1 0 0 0 0 19 20 1 0 0 0 0 19 38 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 39 1 0 0 0 0 22 23 1 0 0 0 0 22 40 1 0 0 0 0 23 24 2 0 0 0 0 23 41 1 0 0 0 0 24 25 1 0 0 0 0 24 42 1 0 0 0 0 25 26 1 0 0 0 0 27 43 1 0 0 0 0 27 44 1 0 0 0 0 M END