structure2.mol corina 01271009043D 1 1.00000 0.00000 CORINA 3.46 0026 05.08.2008 17 18 0 0 0 0 0 0 0 0 1 V2000 0.8234 0.6895 1.0819 C 0 0 0 0 0 0 0 0 0 0 0 0 0.2217 -0.1501 0.1593 C 0 0 0 0 0 0 0 0 0 0 0 0 0.6856 -0.2069 -1.1444 C 0 0 0 0 0 0 0 0 0 0 0 0 1.7522 0.5726 -1.5354 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3682 1.4261 -0.6082 C 0 0 0 0 0 0 0 0 0 0 0 0 1.8908 1.4770 0.7098 C 0 0 0 0 0 0 0 0 0 0 0 0 3.5023 2.2580 -1.0133 C 0 0 0 0 0 0 0 0 0 0 0 0 3.5628 3.5863 -0.6207 C 0 0 0 0 0 0 0 0 0 0 0 0 4.8164 4.3563 -0.6994 C 0 0 0 0 0 0 0 0 0 0 0 0 4.7970 5.6191 -0.3067 N 0 0 0 0 0 0 0 0 0 0 0 0 3.6817 6.1927 0.1498 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3751 4.2938 -0.1116 C 0 0 0 0 0 0 0 0 0 0 0 0 2.5114 5.5589 0.2498 N 0 0 0 0 0 0 0 0 0 0 0 0 1.1642 3.6544 -0.0030 N 0 0 0 0 0 0 0 0 0 0 0 0 3.7350 7.3631 0.4958 O 0 0 0 0 0 0 0 0 0 0 0 0 5.9721 3.7792 -1.1666 N 0 0 0 0 0 0 0 0 0 0 0 0 -0.9450 -1.0077 0.5768 C 0 0 0 0 0 0 0 0 0 0 0 0 1 2 2 0 0 0 0 2 3 1 0 0 0 0 3 4 2 0 0 0 0 4 5 1 0 0 0 0 5 6 2 0 0 0 0 1 6 1 0 0 0 0 5 7 1 0 0 0 0 7 8 2 0 0 0 0 8 9 1 0 0 0 0 9 10 2 0 0 0 0 10 11 1 0 0 0 0 11 13 1 0 0 0 0 12 13 2 0 0 0 0 8 12 1 0 0 0 0 12 14 1 0 0 0 0 11 15 2 0 0 0 0 9 16 1 0 0 0 0 2 17 1 0 0 0 0 M END $$$$