B3OLR0 -OEChem-04022109502D 61 63 0 1 0 0 0 0 0999 V2000 3.0108 5.8566 0.0000 Cl 0 0 0 0 0 0 0 0 0 0 0 0 0.0000 5.8566 0.0000 Cl 0 0 0 0 0 0 0 0 0 0 0 0 10.3730 4.8179 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 7.4247 9.5612 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 7.7907 5.5224 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 8.2907 8.0612 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 8.9717 3.7998 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 8.2907 7.0612 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 8.7907 5.5224 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 9.0997 6.4735 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.4817 6.4735 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.3785 4.7134 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.4695 2.9394 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.9992 3.5940 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.1567 8.5612 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.8063 2.1989 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.8927 2.6056 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.1567 9.5612 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.9108 1.2044 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.0837 2.0179 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.0227 10.0613 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.2907 10.0613 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.1018 0.6166 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.1882 1.0233 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.0227 11.0613 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.2907 11.0613 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.9167 9.5266 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.1567 11.5613 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.9167 11.5959 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.8227 10.0404 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.8227 11.0821 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.5586 10.0613 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.8431 7.3427 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.5092 4.9700 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.6661 6.2213 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.4097 7.0104 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.1717 7.0104 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.9153 6.2213 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.4263 5.0208 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.7538 8.3712 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.8853 2.4795 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.9706 3.3045 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.9353 4.2107 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.3792 3.5953 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.3688 7.9786 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.7673 8.6689 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.4772 0.9522 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.5173 2.2700 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.1666 0.0000 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.6866 0.6589 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.7538 11.3713 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.9095 8.9066 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.1567 12.1813 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.9095 12.2159 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 12.3585 9.7284 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 12.3585 11.3941 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.8686 10.5982 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.0217 10.3713 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.2486 9.5243 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.0108 5.8566 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.0000 5.8566 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1 60 1 0 0 0 0 2 61 1 0 0 0 0 3 12 2 0 0 0 0 4 22 1 0 0 0 0 4 32 1 0 0 0 0 5 9 1 0 0 0 0 5 11 1 0 0 0 0 5 39 1 0 0 0 0 8 6 1 1 0 0 0 6 15 1 0 0 0 0 6 40 1 0 0 0 0 7 12 1 0 0 0 0 7 13 1 0 0 0 0 7 14 1 0 0 0 0 8 10 1 0 0 0 0 8 11 1 0 0 0 0 8 33 1 0 0 0 0 9 10 1 0 0 0 0 9 12 1 1 0 0 0 9 34 1 0 0 0 0 10 35 1 0 0 0 0 10 36 1 0 0 0 0 11 37 1 0 0 0 0 11 38 1 0 0 0 0 13 16 1 0 0 0 0 13 41 1 0 0 0 0 13 42 1 0 0 0 0 14 17 1 0 0 0 0 14 43 1 0 0 0 0 14 44 1 0 0 0 0 15 18 1 0 0 0 0 15 45 1 0 0 0 0 15 46 1 0 0 0 0 16 17 1 0 0 0 0 16 19 2 0 0 0 0 17 20 2 0 0 0 0 18 21 1 0 0 0 0 18 22 2 0 0 0 0 19 23 1 0 0 0 0 19 47 1 0 0 0 0 20 24 1 0 0 0 0 20 48 1 0 0 0 0 21 25 1 0 0 0 0 21 27 2 0 0 0 0 22 26 1 0 0 0 0 23 24 2 0 0 0 0 23 49 1 0 0 0 0 24 50 1 0 0 0 0 25 28 1 0 0 0 0 25 29 2 0 0 0 0 26 28 2 0 0 0 0 26 51 1 0 0 0 0 27 30 1 0 0 0 0 27 52 1 0 0 0 0 28 53 1 0 0 0 0 29 31 1 0 0 0 0 29 54 1 0 0 0 0 30 31 2 0 0 0 0 30 55 1 0 0 0 0 31 56 1 0 0 0 0 32 57 1 0 0 0 0 32 58 1 0 0 0 0 32 59 1 0 0 0 0 M END $$$$