IFLAB-ZINC04941704 MOE2007 3D CORINA 3.40 0006 02.08.2006 45 47 0 0 1 0 0 0 0 0999 V2000 -4.9580 0.2380 1.7750 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.2810 1.3790 2.7420 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.4900 2.6260 2.3410 C 0 0 3 0 0 0 0 0 0 0 0 0 -3.4280 2.3830 2.2940 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.7160 3.7280 3.3770 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.1180 3.9650 3.5220 O 0 0 0 0 0 0 0 0 0 0 0 0 -4.9430 3.0900 1.0270 N 0 0 0 0 0 0 0 0 0 0 0 0 -4.4200 2.5560 -0.0940 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.5730 1.6900 -0.0150 O 0 0 0 0 0 0 0 0 0 0 0 0 -4.8810 3.0280 -1.4330 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.7280 3.8950 -1.5110 O 0 0 0 0 0 0 0 0 0 0 0 0 -4.3580 2.4940 -2.5540 N 0 0 0 0 0 0 0 0 0 0 0 0 -4.8460 2.8750 -3.8000 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.4260 4.0830 -4.1120 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.7710 4.0550 -5.4520 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.4190 2.8790 -5.9490 N 0 0 0 0 0 0 0 0 0 0 0 0 -4.8320 2.1250 -4.9310 N 0 0 0 0 0 0 0 0 0 0 0 0 -4.3220 0.8240 -5.0540 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.0030 -0.1210 -5.8080 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.5000 -1.4010 -5.9280 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.3150 -1.7420 -5.2970 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.6340 -0.8000 -4.5440 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.1310 0.4820 -4.4260 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.8240 -2.9950 -5.4150 F 0 0 0 0 0 0 0 0 0 0 0 0 -6.4320 5.3180 -5.9870 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.0210 6.5820 -4.7250 S 0 0 0 0 0 0 0 0 0 0 0 0 -5.7590 5.3720 -3.3740 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.5210 -0.6510 2.0610 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.2310 0.5310 0.7620 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.8910 0.0190 1.8150 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.3480 1.5970 2.7020 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.0070 1.0860 3.7550 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.2990 3.4180 4.3350 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.2260 4.6440 3.0470 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.3360 4.6540 4.1650 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.6200 3.7820 0.9640 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.6410 1.8440 -2.4920 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.9270 0.1440 -6.3000 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.0300 -2.1370 -6.5140 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.7100 -1.0680 -4.0530 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.5970 1.2180 -3.8430 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.0120 5.5910 -6.9550 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.5120 5.1850 -6.0590 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.6680 5.2520 -2.7840 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.9270 5.6780 -2.7400 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 31 1 0 0 0 0 2 32 1 0 0 0 0 3 4 1 0 0 0 0 3 5 1 0 0 0 0 3 7 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 35 1 0 0 0 0 7 8 1 0 0 0 0 7 36 1 0 0 0 0 8 9 2 0 0 0 0 8 10 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 37 1 0 0 0 0 13 14 2 0 0 0 0 13 17 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 25 1 0 0 0 0 16 17 1 0 0 0 0 17 18 1 0 0 0 0 18 19 1 0 0 0 0 18 23 2 0 0 0 0 19 20 2 0 0 0 0 19 38 1 0 0 0 0 20 21 1 0 0 0 0 20 39 1 0 0 0 0 21 22 2 0 0 0 0 21 24 1 0 0 0 0 22 23 1 0 0 0 0 22 40 1 0 0 0 0 23 41 1 0 0 0 0 25 26 1 0 0 0 0 25 42 1 0 0 0 0 25 43 1 0 0 0 0 26 27 1 0 0 0 0 27 44 1 0 0 0 0 27 45 1 0 0 0 0 M END