DR1976 -OEChem-05042004162D 45 48 0 1 0 0 0 0 0999 V2000 9.1857 2.7688 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 4.3472 -2.5846 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 2.5357 -1.5388 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 7.9288 1.5136 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 7.9288 0.5136 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 7.0628 0.0136 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 6.1968 0.5136 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 8.8750 1.8183 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 7.0628 2.0136 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.8750 0.2088 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.1968 1.5136 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.4586 1.0136 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.0789 -1.0280 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.9288 2.5136 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.2868 0.0067 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.1808 -1.5557 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.2787 -1.0349 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.3599 0.5708 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.3433 -1.5846 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.4120 0.0429 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.4037 -1.0421 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.0188 -0.3317 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.8022 -0.4058 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.9329 0.9386 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.4875 1.9145 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.4613 2.4885 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.6643 2.4885 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.6240 -0.3581 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.4124 -0.1004 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.9847 2.0962 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.5862 1.4059 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.9195 0.5988 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.9195 1.4283 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.2969 -1.6084 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.6880 -0.9124 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.5488 2.5136 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.9288 3.1336 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.3088 2.5136 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.7835 -2.0317 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.5818 -2.0286 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.7924 2.8967 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.3719 1.1907 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.8787 0.3590 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.8114 -2.8967 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.0000 -1.2267 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8 1 1 1 0 0 0 1 41 1 0 0 0 0 2 19 1 0 0 0 0 2 44 1 0 0 0 0 3 21 1 0 0 0 0 3 45 1 0 0 0 0 4 5 1 0 0 0 0 4 8 1 0 0 0 0 4 9 1 0 0 0 0 4 14 1 1 0 0 0 5 6 1 0 0 0 0 5 10 1 0 0 0 0 5 22 1 6 0 0 0 6 7 1 0 0 0 0 6 13 1 0 0 0 0 6 23 1 1 0 0 0 7 11 1 0 0 0 0 7 15 1 0 0 0 0 7 24 1 6 0 0 0 8 12 1 0 0 0 0 8 25 1 0 0 0 0 9 11 1 0 0 0 0 9 26 1 0 0 0 0 9 27 1 0 0 0 0 10 12 1 0 0 0 0 10 28 1 0 0 0 0 10 29 1 0 0 0 0 11 30 1 0 0 0 0 11 31 1 0 0 0 0 12 32 1 0 0 0 0 12 33 1 0 0 0 0 13 16 1 0 0 0 0 13 34 1 0 0 0 0 13 35 1 0 0 0 0 14 36 1 0 0 0 0 14 37 1 0 0 0 0 14 38 1 0 0 0 0 15 17 2 0 0 0 0 15 18 1 0 0 0 0 16 17 1 0 0 0 0 16 39 1 0 0 0 0 16 40 1 0 0 0 0 17 19 1 0 0 0 0 18 20 2 0 0 0 0 18 42 1 0 0 0 0 19 21 2 0 0 0 0 20 21 1 0 0 0 0 20 43 1 0 0 0 0 M END $$$$