IBS-ZINC06624587 MOE2007 3D CORINA 3.40 0006 02.08.2006 46 51 0 0 0 0 0 0 0 0999 V2000 -0.0170 1.3820 0.0100 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0020 -0.0040 0.0020 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1960 -0.6930 -0.0130 C 0 0 0 0 0 0 0 0 0 0 0 0 2.4030 0.0080 -0.0210 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3760 1.4210 -0.0130 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1650 2.0970 0.0020 C 0 0 0 0 0 0 0 0 0 0 0 0 3.6720 2.1270 -0.0210 C 0 0 0 0 0 0 0 0 0 0 0 0 4.8140 1.3400 -0.0380 C 0 0 0 0 0 0 0 0 0 0 0 0 6.0940 1.8900 -0.0470 C 0 0 0 0 0 0 0 0 0 0 0 0 6.1770 3.2790 -0.0400 C 0 0 0 0 0 0 0 0 0 0 0 0 5.0000 4.0120 -0.0240 C 0 0 0 0 0 0 0 0 0 0 0 0 3.8040 3.4460 -0.0140 N 0 0 0 0 0 0 0 0 0 0 0 0 7.0040 0.7340 -0.0640 C 0 0 0 0 0 0 0 0 0 0 0 0 8.3900 0.6030 -0.0810 C 0 0 0 0 0 0 0 0 0 0 0 0 8.9650 -0.6540 -0.0940 C 0 0 0 0 0 0 0 0 0 0 0 0 8.1620 -1.7880 -0.0910 C 0 0 0 0 0 0 0 0 0 0 0 0 6.7890 -1.6710 -0.0760 C 0 0 0 0 0 0 0 0 0 0 0 0 6.1920 -0.4170 -0.0620 C 0 0 0 0 0 0 0 0 0 0 0 0 4.8540 -0.0230 -0.0460 N 0 0 0 0 0 0 0 0 0 0 0 0 3.6890 -0.7110 -0.0380 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7040 -1.9270 -0.0440 O 0 0 0 0 0 0 0 0 0 0 0 0 10.3190 -0.7810 -0.1100 O 0 0 0 0 0 0 0 0 0 0 0 0 10.8460 -2.1090 -0.1230 C 0 0 0 0 0 0 0 0 0 0 0 0 12.3520 -2.0510 -0.1400 C 0 0 0 0 0 0 0 0 0 0 0 0 12.9180 -0.9790 -0.1410 O 0 0 0 0 0 0 0 0 0 0 0 0 13.0700 -3.1920 -0.1550 N 0 0 0 0 0 0 0 0 0 0 0 0 14.5340 -3.1360 -0.1710 C 0 0 0 0 0 0 0 0 0 0 0 0 15.2800 -4.3350 -0.7600 C 0 0 0 0 0 0 0 0 0 0 0 0 15.2880 -4.0960 0.7520 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.9610 1.9060 0.0170 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9290 -0.5500 0.0080 H 0 0 0 0 0 0 0 0 0 0 0 0 1.1970 -1.7730 -0.0180 H 0 0 0 0 0 0 0 0 0 0 0 0 1.1460 3.1770 0.0080 H 0 0 0 0 0 0 0 0 0 0 0 0 7.1360 3.7750 -0.0460 H 0 0 0 0 0 0 0 0 0 0 0 0 5.0620 5.0900 -0.0180 H 0 0 0 0 0 0 0 0 0 0 0 0 9.0150 1.4840 -0.0830 H 0 0 0 0 0 0 0 0 0 0 0 0 8.6170 -2.7680 -0.1020 H 0 0 0 0 0 0 0 0 0 0 0 0 6.1740 -2.5590 -0.0750 H 0 0 0 0 0 0 0 0 0 0 0 0 10.5130 -2.6410 0.7680 H 0 0 0 0 0 0 0 0 0 0 0 0 10.4920 -2.6310 -1.0120 H 0 0 0 0 0 0 0 0 0 0 0 0 12.6170 -4.0500 -0.1540 H 0 0 0 0 0 0 0 0 0 0 0 0 14.9650 -2.1480 -0.3300 H 0 0 0 0 0 0 0 0 0 0 0 0 14.6810 -5.1660 -1.1350 H 0 0 0 0 0 0 0 0 0 0 0 0 16.2020 -4.1360 -1.3060 H 0 0 0 0 0 0 0 0 0 0 0 0 16.2150 -3.7390 1.2000 H 0 0 0 0 0 0 0 0 0 0 0 0 14.6940 -4.7690 1.3710 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 6 2 0 0 0 0 1 30 1 0 0 0 0 2 3 2 0 0 0 0 2 31 1 0 0 0 0 3 4 1 0 0 0 0 3 32 1 0 0 0 0 4 5 2 0 0 0 0 4 20 1 0 0 0 0 5 6 1 0 0 0 0 5 7 1 0 0 0 0 6 33 1 0 0 0 0 7 8 1 0 0 0 0 7 12 2 0 0 0 0 8 9 2 0 0 0 0 8 19 1 0 0 0 0 9 10 1 0 0 0 0 9 13 1 0 0 0 0 10 11 2 0 0 0 0 10 34 1 0 0 0 0 11 12 1 0 0 0 0 11 35 1 0 0 0 0 13 14 1 0 0 0 0 13 18 2 0 0 0 0 14 15 2 0 0 0 0 14 36 1 0 0 0 0 15 16 1 0 0 0 0 15 22 1 0 0 0 0 16 17 2 0 0 0 0 16 37 1 0 0 0 0 17 18 1 0 0 0 0 17 38 1 0 0 0 0 18 19 1 0 0 0 0 19 20 1 0 0 0 0 20 21 2 0 0 0 0 22 23 1 0 0 0 0 23 24 1 0 0 0 0 23 39 1 0 0 0 0 23 40 1 0 0 0 0 24 25 2 0 0 0 0 24 26 1 0 0 0 0 26 27 1 0 0 0 0 26 41 1 0 0 0 0 27 28 1 0 0 0 0 27 29 1 0 0 0 0 27 42 1 0 0 0 0 28 29 1 0 0 0 0 28 43 1 0 0 0 0 28 44 1 0 0 0 0 29 45 1 0 0 0 0 29 46 1 0 0 0 0 M END