B96MUS -OEChem-04022100352D 35 38 0 0 0 0 0 0 0999 V2000 3.5298 1.2154 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 5.2619 0.2154 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 5.2619 -1.7846 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.2619 -2.7846 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.3958 -1.2846 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.3958 -3.2846 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.5298 -2.7846 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.3958 -0.2846 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.5298 -1.7846 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.5298 0.2154 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.3958 1.7154 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.2619 1.2154 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.5836 -0.0894 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.5836 1.5201 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0000 0.7154 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.3798 2.7569 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.1719 1.7222 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.2778 3.2846 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.1799 2.7638 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.8725 -1.8923 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.4739 -1.2020 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.4739 -3.3672 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.8725 -2.6770 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.9973 -3.7596 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.7944 -3.7596 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.9192 -2.6770 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.3178 -3.3672 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.9929 -1.4746 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.3910 -0.6787 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.3910 2.1094 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.3800 0.7154 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.8393 3.0606 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.7052 1.4060 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.2754 3.9046 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.7180 3.0717 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1 10 1 0 0 0 0 1 11 1 0 0 0 0 1 14 1 0 0 0 0 2 8 2 0 0 0 0 2 12 1 0 0 0 0 3 4 1 0 0 0 0 3 5 1 0 0 0 0 3 20 1 0 0 0 0 3 21 1 0 0 0 0 4 6 1 0 0 0 0 4 22 1 0 0 0 0 4 23 1 0 0 0 0 5 8 1 0 0 0 0 5 9 2 0 0 0 0 6 7 1 0 0 0 0 6 24 1 0 0 0 0 6 25 1 0 0 0 0 7 9 1 0 0 0 0 7 26 1 0 0 0 0 7 27 1 0 0 0 0 8 10 1 0 0 0 0 9 28 1 0 0 0 0 10 13 2 0 0 0 0 11 12 1 0 0 0 0 11 16 2 0 0 0 0 12 17 2 0 0 0 0 13 15 1 0 0 0 0 13 29 1 0 0 0 0 14 15 2 0 0 0 0 14 30 1 0 0 0 0 15 31 1 0 0 0 0 16 18 1 0 0 0 0 16 32 1 0 0 0 0 17 19 1 0 0 0 0 17 33 1 0 0 0 0 18 19 2 0 0 0 0 18 34 1 0 0 0 0 19 35 1 0 0 0 0 M END $$$$