BOPJ98
-OEChem-04022111323D
49 53 0 0 0 0 0 0 0999 V2000
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-2.9209 -0.0212 1.9858 O 0 0 0 0 0 0 0 0 0 0 0 0
0.9057 -0.1030 0.2797 C 0 0 0 0 0 0 0 0 0 0 0 0
-0.3243 -0.5570 -0.4917 C 0 0 0 0 0 0 0 0 0 0 0 0
-1.6095 -0.5347 0.0694 C 0 0 0 0 0 0 0 0 0 0 0 0
3.6117 0.1797 -0.0056 C 0 0 0 0 0 0 0 0 0 0 0 0
0.5823 0.3580 1.6820 C 0 0 0 0 0 0 0 0 0 0 0 0
3.0827 -1.0437 0.3873 C 0 0 0 0 0 0 0 0 0 0 0 0
2.7630 1.1982 -0.4219 C 0 0 0 0 0 0 0 0 0 0 0 0
-0.1800 -1.0172 -1.8141 C 0 0 0 0 0 0 0 0 0 0 0 0
5.0105 0.3798 -0.0042 C 0 0 0 0 0 0 0 0 0 0 0 0
-1.8174 -0.0604 1.4543 C 0 0 0 0 0 0 0 0 0 0 0 0
-2.7192 -0.9612 -0.6730 C 0 0 0 0 0 0 0 0 0 0 0 0
-0.6383 0.3825 2.2229 C 0 0 0 0 0 0 0 0 0 0 0 0
3.9207 -2.0877 0.7760 C 0 0 0 0 0 0 0 0 0 0 0 0
3.2778 2.4208 -0.8504 C 0 0 0 0 0 0 0 0 0 0 0 0
-1.2852 -1.4416 -2.5518 C 0 0 0 0 0 0 0 0 0 0 0 0
-2.5536 -1.4133 -1.9812 C 0 0 0 0 0 0 0 0 0 0 0 0
5.8456 -0.6723 0.4047 C 0 0 0 0 0 0 0 0 0 0 0 0
5.5187 1.6202 -0.4220 C 0 0 0 0 0 0 0 0 0 0 0 0
5.3014 -1.8991 0.7895 C 0 0 0 0 0 0 0 0 0 0 0 0
4.6551 2.6326 -0.8444 C 0 0 0 0 0 0 0 0 0 0 0 0
-4.9508 -0.1610 -0.8599 C 0 0 0 0 0 0 0 0 0 0 0 0
-5.9867 0.3223 0.1189 C 0 0 0 0 0 0 0 0 0 0 0 0
-6.7538 -0.7694 0.8208 C 0 0 0 0 0 0 0 0 0 0 0 0
-6.2694 1.6147 0.3719 C 0 0 0 0 0 0 0 0 0 0 0 0
-5.6241 2.8331 -0.2052 C 0 0 0 0 0 0 0 0 0 0 0 0
1.4132 0.6969 2.2974 H 0 0 0 0 0 0 0 0 0 0 0 0
0.8031 -1.0477 -2.2787 H 0 0 0 0 0 0 0 0 0 0 0 0
-0.7934 0.7281 3.2387 H 0 0 0 0 0 0 0 0 0 0 0 0
3.5058 -3.0464 1.0746 H 0 0 0 0 0 0 0 0 0 0 0 0
2.6132 3.2131 -1.1836 H 0 0 0 0 0 0 0 0 0 0 0 0
-1.1541 -1.7959 -3.5700 H 0 0 0 0 0 0 0 0 0 0 0 0
-3.4013 -1.7582 -2.5671 H 0 0 0 0 0 0 0 0 0 0 0 0
6.9262 -0.5481 0.4181 H 0 0 0 0 0 0 0 0 0 0 0 0
6.5906 1.8048 -0.4302 H 0 0 0 0 0 0 0 0 0 0 0 0
5.9562 -2.7091 1.0977 H 0 0 0 0 0 0 0 0 0 0 0 0
5.0584 3.5864 -1.1721 H 0 0 0 0 0 0 0 0 0 0 0 0
-5.4435 -0.7834 -1.6170 H 0 0 0 0 0 0 0 0 0 0 0 0
-4.4629 0.6628 -1.3891 H 0 0 0 0 0 0 0 0 0 0 0 0
-7.2363 -1.4248 0.0882 H 0 0 0 0 0 0 0 0 0 0 0 0
-6.0829 -1.3732 1.4404 H 0 0 0 0 0 0 0 0 0 0 0 0
-7.5382 -0.3734 1.4746 H 0 0 0 0 0 0 0 0 0 0 0 0
-7.0568 1.8349 1.0915 H 0 0 0 0 0 0 0 0 0 0 0 0
-5.2872 3.4849 0.6076 H 0 0 0 0 0 0 0 0 0 0 0 0
-4.7567 2.6238 -0.8329 H 0 0 0 0 0 0 0 0 0 0 0 0
-6.3530 3.3883 -0.8037 H 0 0 0 0 0 0 0 0 0 0 0 0
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29 47 1 0 0 0 0
29 48 1 0 0 0 0
29 49 1 0 0 0 0
M END
$$$$