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[求助]
求下面結(jié)構(gòu)中的拓撲標號
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| 如題 |
木蟲 (著名寫手)
上書房行走

木蟲 (著名寫手)
上書房行走
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################## 1:X74-80 in P-1 #2 ################## Topology for Zn1 -------------------- Atom Zn1 links by bridge ligands and has Common vertex with R(A-A) Zn 1 0.5739 0.3399 0.4970 ( 1 1 1) 3.567A 1 Zn 1 1.4261 1.6601 0.5030 ( 1 1 0) 9.660A 1 Zn 1 -0.5739 -0.3399 0.5030 (-1-1 0) 9.660A 1 Zn 1 0.5739 1.3399 1.4970 ( 1 2 2) 11.210A 1 Zn 1 0.5739 0.3399 -0.5030 ( 1 1 0) 11.339A 1 ------------------------- Structural group analysis ------------------------- ------------------------- Structural group No 1 ------------------------- Structure consists of 3D framework with Zn Coordination sequences ---------------------- Zn1: 1 2 3 4 5 6 7 8 9 10 Num 5 14 29 50 77 110 149 194 245 302 Cum 6 20 49 99 176 286 435 629 874 1176 ---------------------- TD10=1176 Vertex symbols for selected sublattice -------------------------------------- Zn1 Point symbol:{4^6.6^4} Extended point symbol:[4.4.4.4.4.4.6(3).6(3).6(3).6(3)] -------------------------------------- Point symbol for net: {4^6.6^4} 5-c net; uninodal net Topological type: bnn hexagonal BN; 5/4/h5; sqc12 (topos&RCSR.ttd) {4^6.6^4} - VS [4.4.4.4.4.4.6.6.6.*] (16813 types in 3 databases) Elapsed time: 14.36 sec. |

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