IBS-ZINC06662618 MOE2007 3D CORINA 3.40 0006 02.08.2006 37 39 0 0 0 0 0 0 0 0999 V2000 -0.0180 1.5030 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 0.0230 -0.6970 1.2040 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0420 -2.0640 1.2140 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0400 -2.7650 0.0090 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0190 -2.0690 -1.2110 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0060 -0.6800 -1.2000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0220 -2.9890 -2.1970 O 0 0 0 0 0 0 0 0 0 0 0 0 0.0440 -4.2340 -1.6900 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0560 -4.1880 -0.3510 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0810 -5.3600 0.5950 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.3260 -5.6930 1.0200 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.2580 -5.0420 0.5970 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.5500 -6.7140 1.8710 N 0 0 0 0 0 0 0 0 0 0 0 0 -2.9180 -7.0370 2.2840 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.8930 -8.2100 3.2300 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.7780 -8.0070 4.5970 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.7600 -9.1160 5.4290 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.8550 -10.3770 4.8730 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.9620 -10.5320 3.5680 N 0 0 0 0 0 0 0 0 0 0 0 0 -2.9890 -9.5010 2.7470 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0040 1.8800 0.0030 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5460 1.8640 -0.8730 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5290 1.8540 0.9070 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0250 -0.1530 2.1370 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0580 -2.5990 2.1530 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0260 -0.1310 -2.1290 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0500 -5.1400 -2.2780 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5220 -6.2220 0.0940 H 0 0 0 0 0 0 0 0 0 0 0 0 0.6750 -5.1070 1.4730 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.8050 -7.2350 2.2100 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.3590 -6.1760 2.7850 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.5120 -7.2910 1.4060 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.7050 -7.0090 5.0040 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.6710 -8.9950 6.4990 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.8400 -11.2460 5.5140 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.0840 -9.6670 1.6840 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 22 1 0 0 0 0 1 23 1 0 0 0 0 1 24 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 25 1 0 0 0 0 4 5 1 0 0 0 0 4 26 1 0 0 0 0 5 6 2 0 0 0 0 5 10 1 0 0 0 0 6 7 1 0 0 0 0 6 8 1 0 0 0 0 7 27 1 0 0 0 0 8 9 1 0 0 0 0 9 10 2 0 0 0 0 9 28 1 0 0 0 0 10 11 1 0 0 0 0 11 12 1 0 0 0 0 11 29 1 0 0 0 0 11 30 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 31 1 0 0 0 0 15 16 1 0 0 0 0 15 32 1 0 0 0 0 15 33 1 0 0 0 0 16 17 1 0 0 0 0 16 21 2 0 0 0 0 17 18 2 0 0 0 0 17 34 1 0 0 0 0 18 19 1 0 0 0 0 18 35 1 0 0 0 0 19 20 2 0 0 0 0 19 36 1 0 0 0 0 20 21 1 0 0 0 0 21 37 1 0 0 0 0 M END