IFLAB-ZINC02709529 MOE2007 3D CORINA 3.40 0006 02.08.2006 44 47 0 0 0 0 0 0 0 0999 V2000 0.2880 1.0610 0.7890 C 0 0 0 0 0 0 0 0 0 0 0 0 0.2370 -0.4290 0.5710 C 0 0 0 0 0 0 0 0 0 0 0 0 0.2370 -1.2960 1.6530 C 0 0 0 0 0 0 0 0 0 0 0 0 0.1880 -2.6600 1.4090 C 0 0 0 0 0 0 0 0 0 0 0 0 0.1430 -3.0900 0.1590 N 0 0 0 0 0 0 0 0 0 0 0 0 0.1440 -2.2350 -0.8530 C 0 0 0 0 0 0 0 0 0 0 0 0 0.1850 -0.9260 -0.6540 N 0 0 0 0 0 0 0 0 0 0 0 0 0.0970 -2.7200 -2.1480 N 0 0 0 0 0 0 0 0 0 0 0 0 -0.3300 -4.2960 -2.4270 S 0 0 0 0 0 0 0 0 0 0 0 0 -0.3180 -4.4710 -3.8370 O 0 0 0 0 0 0 0 0 0 0 0 0 0.4480 -5.0860 -1.5390 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.0070 -4.4800 -1.9170 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.0310 -4.2570 -2.8200 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.3460 -4.4010 -2.4230 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.6400 -4.7690 -1.1170 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.6090 -4.9920 -0.2130 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.2960 -4.8520 -0.6170 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.9700 -4.9150 -0.7120 N 0 0 0 0 0 0 0 0 0 0 0 0 -6.3280 -4.6080 0.5500 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.5170 -4.1140 1.3090 O 0 0 0 0 0 0 0 0 0 0 0 0 -7.7050 -4.8710 1.0120 C 0 0 0 0 0 0 0 0 0 0 0 0 -8.6430 -5.4410 0.1390 C 0 0 0 0 0 0 0 0 0 0 0 0 -9.9120 -5.6880 0.5530 C 0 0 0 0 0 0 0 0 0 0 0 0 -10.3120 -5.3750 1.8710 C 0 0 0 0 0 0 0 0 0 0 0 0 -9.3750 -4.8060 2.7430 C 0 0 0 0 0 0 0 0 0 0 0 0 -8.0760 -4.5600 2.3170 C 0 0 0 0 0 0 0 0 0 0 0 0 -10.1680 -4.5350 4.2920 S 0 0 0 0 0 0 0 0 0 0 0 0 -11.6280 -5.1750 3.6840 C 0 0 0 0 0 0 0 0 0 0 0 0 -11.5080 -5.5410 2.4620 N 0 0 0 0 0 0 0 0 0 0 0 0 1.3280 1.3890 0.8160 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.2310 1.5650 -0.0260 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.1950 1.3070 1.7350 H 0 0 0 0 0 0 0 0 0 0 0 0 0.2750 -0.9180 2.6640 H 0 0 0 0 0 0 0 0 0 0 0 0 0.1880 -3.3620 2.2290 H 0 0 0 0 0 0 0 0 0 0 0 0 0.3140 -2.1370 -2.8920 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.8020 -3.9700 -3.8350 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.1450 -4.2260 -3.1280 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.8340 -5.2790 0.8040 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.4940 -5.0290 0.0840 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.6350 -5.2380 -1.3400 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.3530 -5.6860 -0.8720 H 0 0 0 0 0 0 0 0 0 0 0 0 -10.6220 -6.1270 -0.1320 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.3570 -4.1250 2.9950 H 0 0 0 0 0 0 0 0 0 0 0 0 -12.5390 -5.2620 4.2570 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 30 1 0 0 0 0 1 31 1 0 0 0 0 1 32 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 33 1 0 0 0 0 4 5 1 0 0 0 0 4 34 1 0 0 0 0 5 6 2 0 0 0 0 6 7 1 0 0 0 0 6 8 1 0 0 0 0 8 9 1 0 0 0 0 8 35 1 0 0 0 0 9 10 2 0 0 0 0 9 11 2 0 0 0 0 9 12 1 0 0 0 0 12 13 1 0 0 0 0 12 17 2 0 0 0 0 13 14 2 0 0 0 0 13 36 1 0 0 0 0 14 15 1 0 0 0 0 14 37 1 0 0 0 0 15 16 2 0 0 0 0 15 18 1 0 0 0 0 16 17 1 0 0 0 0 16 38 1 0 0 0 0 17 39 1 0 0 0 0 18 19 1 0 0 0 0 18 40 1 0 0 0 0 19 20 2 0 0 0 0 19 21 1 0 0 0 0 21 22 1 0 0 0 0 21 26 2 0 0 0 0 22 23 2 0 0 0 0 22 41 1 0 0 0 0 23 24 1 0 0 0 0 23 42 1 0 0 0 0 24 25 2 0 0 0 0 24 29 1 0 0 0 0 25 26 1 0 0 0 0 25 27 1 0 0 0 0 26 43 1 0 0 0 0 27 28 1 0 0 0 0 28 29 2 0 0 0 0 28 44 1 0 0 0 0 M END