IFLAB-ZINC04306799 MOE2007 3D CORINA 3.40 0006 02.08.2006 36 36 0 0 0 0 0 0 0 0999 V2000 0.0690 -2.4460 -2.2020 C 0 0 0 0 0 0 0 0 0 0 0 0 0.1630 -1.6390 -0.9400 C 0 0 0 0 0 0 0 0 0 0 0 0 0.1530 -2.3370 0.2810 C 0 0 0 0 0 0 0 0 0 0 0 0 0.2530 -1.6700 1.5050 C 0 0 0 0 0 0 0 0 0 0 0 0 0.3790 -0.2780 1.5540 C 0 0 0 0 0 0 0 0 0 0 0 0 0.3990 0.4260 0.3410 C 0 0 0 0 0 0 0 0 0 0 0 0 0.2750 -0.2370 -0.8950 C 0 0 0 0 0 0 0 0 0 0 0 0 0.3470 0.7970 -2.3530 S 0 0 0 0 0 0 0 0 0 0 0 0 1.2040 1.9240 -2.0290 O 0 0 0 0 0 0 0 0 0 0 0 0 0.6690 -0.0240 -3.5020 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.2520 1.3710 -2.5210 N 0 0 0 0 0 0 0 0 0 0 0 0 -1.7420 2.3760 -1.5590 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.2940 0.4990 -3.1210 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.1790 -0.2020 -2.0920 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.1220 -1.1960 -2.7680 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.1050 -1.9120 -1.8370 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.0890 -1.5650 -0.6250 O 0 0 0 0 0 0 0 0 0 0 0 0 0.4970 0.4470 2.8740 C 0 0 0 0 0 0 0 0 0 0 0 0 0.5360 1.7180 2.8370 O 0 5 0 0 0 0 0 0 0 0 0 0 -0.7380 -2.0840 -2.8430 H 0 0 0 0 0 0 0 0 0 0 0 0 1.0220 -2.4270 -2.7400 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.1580 -3.4970 -1.9890 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0620 -3.4220 0.2930 H 0 0 0 0 0 0 0 0 0 0 0 0 0.2350 -2.2430 2.4300 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5120 1.5100 0.3740 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.6380 2.8650 -1.9540 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.9890 1.9170 -0.5980 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9970 3.1610 -1.4030 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.9160 1.1270 -3.7720 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.8280 -0.2340 -3.7870 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.5700 -0.7250 -1.3490 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.7690 0.5400 -1.5420 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.7140 -0.6760 -3.5310 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.5310 -1.9650 -3.2820 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.8310 -2.7720 -2.4170 O 0 5 0 0 0 0 0 0 0 0 0 0 0.5640 -0.2650 3.9260 O 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 20 1 0 0 0 0 1 21 1 0 0 0 0 1 22 1 0 0 0 0 2 3 1 0 0 0 0 2 7 2 0 0 0 0 3 4 2 0 0 0 0 3 23 1 0 0 0 0 4 5 1 0 0 0 0 4 24 1 0 0 0 0 5 6 2 0 0 0 0 5 18 1 0 0 0 0 6 7 1 0 0 0 0 6 25 1 0 0 0 0 7 8 1 0 0 0 0 8 9 2 0 0 0 0 8 10 2 0 0 0 0 8 11 1 0 0 0 0 11 12 1 0 0 0 0 11 13 1 0 0 0 0 12 26 1 0 0 0 0 12 27 1 0 0 0 0 12 28 1 0 0 0 0 13 14 1 0 0 0 0 13 29 1 0 0 0 0 13 30 1 0 0 0 0 14 15 1 0 0 0 0 14 31 1 0 0 0 0 14 32 1 0 0 0 0 15 16 1 0 0 0 0 15 33 1 0 0 0 0 15 34 1 0 0 0 0 16 17 2 0 0 0 0 16 35 1 0 0 0 0 18 19 1 0 0 0 0 18 36 2 0 0 0 0 M CHG 1 19 -1 M CHG 1 35 -1 M END