Output from "TOTOPOL", (version 1.92, 17 Jul 2017, Mike Treacy).

Report for the framework in file "public/tmp/tmp_111_2_23123_at2xCB.cif"

There are 16 T-atoms per unit cell
There are 32 O-atoms per unit cell

Framework density = 26.32 T-atoms per nm^3
Material density = 2.626 grams per cm^3 (excluding extra-framework material)
-------------------------------------------------------------------
-------------------------- T-O Analysis ---------------------------
-------------------------------------------------------------------
[Si] Ideal SiO distance = 1.610 Angstrom
T1  -- O1  = 1.6034 Angstrom
T1  -- O3  = 1.5242 Angstrom
T1  -- O4  = 1.7083 Angstrom
T1  -- O2  = 1.7227 Angstrom
      mean = 1.6396 Angstrom
        t1 = 0.108413  (0.0 is a perfect SiO4 tetrahedron)
        t2 = 0.077061  (0.0 is a perfect tetrahedron)

[Si] Ideal SiO distance = 1.610 Angstrom
T2  -- O4  = 1.7497 Angstrom
T2  -- O5  = 1.7491 Angstrom
T2  -- O6  = 1.5618 Angstrom
T2  -- O7  = 1.6394 Angstrom
      mean = 1.6750 Angstrom
        t1 = 0.104881  (0.0 is a perfect SiO4 tetrahedron)
        t2 = 0.064817  (0.0 is a perfect tetrahedron)

        T-O SUMMARY
          Range  = 1.5242 A <--> 1.7497 A
          Mean   = 1.6573 A
          StdDev = 0.0827 A

       t1 Range  = 0.1049 <-- 0.1066 --> 0.1084
       t2 Range  = 0.0648 <-- 0.0709 --> 0.0771

-------------------------------------------------------------------
------------------------- O-T-O Analysis --------------------------
-------------------------------------------------------------------
O1  -- T1  -- O3  =  89.661 deg; O1  -- O3  = 2 A
O1  -- T1  -- O4  = 114.400 deg; O1  -- O4  = 3 A
O1  -- T1  -- O2  = 112.424 deg; O1  -- O2  = 3 A
O3  -- T1  -- O4  =  96.853 deg; O3  -- O4  = 2 A
O3  -- T1  -- O2  = 103.147 deg; O3  -- O2  = 3 A
O4  -- T1  -- O2  = 128.741 deg; O4  -- O2  = 3 A
       89.661 deg <-- 107.538 deg --> 128.741 deg

O4  -- T2  -- O5  = 126.615 deg; O4  -- O5  = 3 A
O4  -- T2  -- O6  = 104.718 deg; O4  -- O6  = 3 A
O4  -- T2  -- O7  = 112.721 deg; O4  -- O7  = 3 A
O5  -- T2  -- O6  =  96.837 deg; O5  -- O6  = 2 A
O5  -- T2  -- O7  = 114.478 deg; O5  -- O7  = 3 A
O6  -- T2  -- O7  =  92.419 deg; O6  -- O7  = 2 A
       92.419 deg <-- 107.965 deg --> 126.615 deg

        O-T-O SUMMARY
          Range  = 89.6611 deg <--> 128.7413 deg
          Mean   = 109.8369 deg
          StdDev = 12.2832 deg

        O--O SUMMARY
          Range  = 2.2057 A <--> 3.1259 A
          Mean   = 2.7168 A
          StdDev = 0.2780 A

-------------------------------------------------------------------
------------------------- T-T-T Analysis --------------------------
-------------------------------------------------------------------
-------------------------------------------------------------------
------------------------- T-O-T Analysis --------------------------
-------------------------------------------------------------------
T1  -- O1  -- T1  = 137.003 deg ; T1  -- T1   2.9836 A

T1  -- O2  -- T1  = 155.092 deg ; T1  -- T1   3.3643 A

T1  -- O3  -- T1  = 134.898 deg ; T1  -- T1   2.8153 A

T1  -- O4  -- T2  = 158.673 deg ; T1  -- T2   3.3983 A

T2  -- O5  -- T2  = 137.028 deg ; T2  -- T2   3.2552 A

T2  -- O6  -- T2  = 104.353 deg ; T2  -- T2   2.4673 A

T2  -- O7  -- T2  = 144.376 deg ; T2  -- T2   3.1216 A


        T-O-T SUMMARY
          Range  = 104.3532° <--> 158.6727 deg
          Mean   = 138.7746 deg
          StdDev = 16.6225 deg

        T--T SUMMARY
          Range  = 2.4673 A <--> 3.3983 A
          Mean   = 3.0579 A
          StdDev = 0.3112 A

-------------------------------------------------------------------
------------------------ *** WARNINGS *** -------------------------
-------------------------------------------------------------------

SOME OXYGEN ATOMS ARE TOO CLOSE TO EACH OTHER
O1  -- O3  = 2.2057 A
O1  -- O3  = 2.2057 A

T-T-T analysis was not conducted.

SOME T-ATOM DISTANCES ARE OUTSIDE THE NORMAL RANGE
T1  has 5 neighboring T-atoms within 3.50 A, but only 4 bridging O-atoms
  T1  -- T1  = 2.8153 Angstrom
  T1  -- T2  = 3.3983 Angstrom
  T1  -- T1  = 3.3643 Angstrom
  T1  -- T1  = 2.9836 Angstrom
  T1  -- T2  = 2.8935 Angstrom
T2  has 6 neighboring T-atoms within 3.50 A, but only 4 bridging O-atoms
  T2  -- T1  = 3.3983 Angstrom
  T2  -- T2  = 2.4673 Angstrom
  T2  -- T2  = 3.1216 Angstrom
  T2  -- T1  = 2.8935 Angstrom
  T2  -- T2  = 2.6683 Angstrom
  T2  -- T2  = 3.2552 Angstrom

-------------------------------------------------------------------
---------------------- Topological Analysis -----------------------
-------------------------------------------------------------------
T1 (Si): multiplicity = 8
Coordination Sequence =
    1 4 9 20 44 81 123 167 220 283 351 431 524 611 694 802 933
TD10 = 1303
Circuit symbol = 4.6.4.8.4.8_{6}
Weight = 19
Vertex symbol  = 4.6.4.8_{5}.4.10_{6}
Weight = 35

T2 (Si): multiplicity = 8
Coordination Sequence =
    1 4 11 26 48 78 118 165 219 279 346 423 506 599 706 814 922
TD10 = 1295
Circuit symbol = 4.8_{2}.6.8_{4}.6.8_{5}
Weight = 33
Vertex symbol  = 4.8_{2}.6.8_{3}.6.8_{4}
Weight = 33

<TD10> = 1299.000
Average ring size = 7.0130
