IFLAB-ZINC02712778 MOE2007 3D CORINA 3.40 0006 02.08.2006 29 29 0 0 0 0 0 0 0 0999 V2000 -0.0160 1.3460 0.0090 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 1.2000 -0.6660 -0.0130 N 0 0 0 0 0 0 0 0 0 0 0 0 1.2130 -1.6350 -0.0180 H 0 0 0 0 0 0 0 0 0 0 0 0 2.3590 0.0170 -0.0210 C 0 0 0 0 0 0 0 0 0 0 0 0 3.4120 -0.5910 -0.0340 O 0 0 0 0 0 0 0 0 0 0 0 0 2.3700 1.3630 -0.0140 N 0 0 0 0 0 0 0 0 0 0 0 0 3.2150 1.8390 -0.0210 H 0 0 0 0 0 0 0 0 0 0 0 0 1.2110 2.0520 0.0020 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2200 3.2690 0.0080 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.2900 -0.7790 0.0110 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.6720 -1.1360 -1.4030 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.9640 -0.7940 -2.3260 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.8000 -1.8340 -1.6410 N 0 0 0 0 0 0 0 0 0 0 0 0 -3.1700 -2.1810 -3.0150 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.4830 -2.9680 -3.0060 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.8700 -3.3300 -4.4410 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.0950 -4.0640 -4.4330 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.9550 1.8800 0.0170 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.1640 -1.6910 0.5940 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.0770 -0.1690 0.4560 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.3660 -2.1070 -0.9020 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.2970 -1.2690 -3.5980 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.3840 -2.7910 -3.4600 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.3560 -3.8800 -2.4230 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.2690 -2.3580 -2.5610 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.9970 -2.4180 -5.0250 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.0840 -3.9400 -4.8870 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.4020 -4.3280 -5.3120 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 2 0 0 0 0 1 9 1 0 0 0 0 1 19 1 0 0 0 0 2 3 1 0 0 0 0 2 11 1 0 0 0 0 3 4 1 0 0 0 0 3 5 1 0 0 0 0 5 6 2 0 0 0 0 5 7 1 0 0 0 0 7 8 1 0 0 0 0 7 9 1 0 0 0 0 9 10 2 0 0 0 0 11 12 1 0 0 0 0 11 20 1 0 0 0 0 11 21 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 22 1 0 0 0 0 15 16 1 0 0 0 0 15 23 1 0 0 0 0 15 24 1 0 0 0 0 16 17 1 0 0 0 0 16 25 1 0 0 0 0 16 26 1 0 0 0 0 17 18 1 0 0 0 0 17 27 1 0 0 0 0 17 28 1 0 0 0 0 18 29 1 0 0 0 0 M END