IBS-ZINC02106494 MOE2007 3D CORINA 3.40 0006 02.08.2006 43 43 0 0 1 0 0 0 0 0999 V2000 0.5910 2.1350 -0.4770 C 0 0 0 0 0 0 0 0 0 0 0 0 1.3100 0.9140 -0.3560 O 0 0 0 0 0 0 0 0 0 0 0 0 1.4510 0.1640 -1.4910 C 0 0 0 0 0 0 0 0 0 0 0 0 2.1630 -1.0270 -1.3200 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3780 -1.8920 -2.3940 C 0 0 0 0 0 0 0 0 0 0 0 0 1.8830 -1.5710 -3.6610 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1680 -0.3780 -3.8330 C 0 0 0 0 0 0 0 0 0 0 0 0 0.9540 0.4860 -2.7540 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0780 -2.5090 -4.8240 C 0 0 0 0 0 0 0 0 0 0 0 0 0.8590 -3.4090 -5.0240 C 0 0 0 0 0 0 0 0 0 0 0 0 0.9990 -4.2570 -6.1880 N 0 0 0 0 0 0 0 0 0 0 0 0 0.7960 -3.7810 -7.4620 C 0 0 0 0 0 0 0 0 0 0 0 0 0.4970 -2.6190 -7.7150 O 0 0 0 0 0 0 0 0 0 0 0 0 0.9800 -4.7550 -8.4030 N 0 0 0 0 0 0 0 0 0 0 0 0 0.8610 -4.5690 -9.8540 C 0 0 3 0 0 0 0 0 0 0 0 0 0.0650 -3.8400 -10.0480 H 0 0 0 0 0 0 0 0 0 0 0 0 2.1840 -4.1180 -10.4960 C 0 0 0 0 0 0 0 0 0 0 0 0 2.5910 -2.7040 -10.0840 C 0 0 0 0 0 0 0 0 0 0 0 0 4.0710 -2.1750 -11.0110 S 0 0 0 0 0 0 0 0 0 0 0 0 4.2520 -0.5230 -10.2980 C 0 0 0 0 0 0 0 0 0 0 0 0 0.5080 -5.9180 -10.5470 C 0 0 0 0 0 0 0 0 0 0 0 0 0.7810 -6.9440 -9.8500 O 0 0 0 0 0 0 0 0 0 0 0 0 1.0930 2.8230 -1.1650 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.4450 1.9550 -0.7820 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5700 2.6080 0.5090 H 0 0 0 0 0 0 0 0 0 0 0 0 2.5520 -1.2850 -0.3380 H 0 0 0 0 0 0 0 0 0 0 0 0 2.9300 -2.8140 -2.2330 H 0 0 0 0 0 0 0 0 0 0 0 0 0.7680 -0.1210 -4.8120 H 0 0 0 0 0 0 0 0 0 0 0 0 0.3940 1.3970 -2.9340 H 0 0 0 0 0 0 0 0 0 0 0 0 2.2820 -1.9200 -5.7280 H 0 0 0 0 0 0 0 0 0 0 0 0 2.9750 -3.1220 -4.6680 H 0 0 0 0 0 0 0 0 0 0 0 0 0.7170 -4.0660 -4.1580 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0540 -2.8130 -5.1420 H 0 0 0 0 0 0 0 0 0 0 0 0 1.2490 -5.2280 -6.0690 H 0 0 0 0 0 0 0 0 0 0 0 0 1.1830 -5.7180 -8.1490 H 0 0 0 0 0 0 0 0 0 0 0 0 2.9820 -4.8230 -10.2270 H 0 0 0 0 0 0 0 0 0 0 0 0 2.0840 -4.1560 -11.5890 H 0 0 0 0 0 0 0 0 0 0 0 0 1.7790 -2.0000 -10.2880 H 0 0 0 0 0 0 0 0 0 0 0 0 2.8370 -2.6690 -9.0190 H 0 0 0 0 0 0 0 0 0 0 0 0 3.3650 0.0810 -10.5050 H 0 0 0 0 0 0 0 0 0 0 0 0 4.4090 -0.5900 -9.2180 H 0 0 0 0 0 0 0 0 0 0 0 0 5.1190 -0.0310 -10.7450 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0080 -5.8280 -11.6960 O 0 5 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 23 1 0 0 0 0 1 24 1 0 0 0 0 1 25 1 0 0 0 0 2 3 1 0 0 0 0 3 4 1 0 0 0 0 3 8 2 0 0 0 0 4 5 2 0 0 0 0 4 26 1 0 0 0 0 5 6 1 0 0 0 0 5 27 1 0 0 0 0 6 7 2 0 0 0 0 6 9 1 0 0 0 0 7 8 1 0 0 0 0 7 28 1 0 0 0 0 8 29 1 0 0 0 0 9 10 1 0 0 0 0 9 30 1 0 0 0 0 9 31 1 0 0 0 0 10 11 1 0 0 0 0 10 32 1 0 0 0 0 10 33 1 0 0 0 0 11 12 1 0 0 0 0 11 34 1 0 0 0 0 12 13 2 0 0 0 0 12 14 1 0 0 0 0 14 15 1 0 0 0 0 14 35 1 0 0 0 0 15 16 1 0 0 0 0 15 17 1 0 0 0 0 15 21 1 0 0 0 0 17 18 1 0 0 0 0 17 36 1 0 0 0 0 17 37 1 0 0 0 0 18 19 1 0 0 0 0 18 38 1 0 0 0 0 18 39 1 0 0 0 0 19 20 1 0 0 0 0 20 40 1 0 0 0 0 20 41 1 0 0 0 0 20 42 1 0 0 0 0 21 22 2 0 0 0 0 21 43 1 0 0 0 0 M CHG 1 43 -1 M END