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

Report for the framework in file "public/tmp/tmp_119_5_55143191__NYSWj.cif"

There are 80 T-atoms per unit cell
There are 160 O-atoms per unit cell

Framework density = 19.52 T-atoms per nm^3
Material density = 1.947 grams per cm^3 (excluding extra-framework material)
-------------------------------------------------------------------
-------------------------- T-O Analysis ---------------------------
-------------------------------------------------------------------
[Si] Ideal SiO distance = 1.610 Angstrom
T1  -- O2  = 1.5769 Angstrom
T1  -- O1  = 1.6121 Angstrom
T1  -- O3  = 1.5687 Angstrom
T1  -- O4  = 1.6594 Angstrom
      mean = 1.6043 Angstrom
        t1 = 0.126144  (0.0 is a perfect SiO4 tetrahedron)
        t2 = 0.120140  (0.0 is a perfect tetrahedron)

[Si] Ideal SiO distance = 1.610 Angstrom
T2  -- O3  = 1.5690 Angstrom
T2  -- O6  = 1.5816 Angstrom
T2  -- O5  = 1.6026 Angstrom
T2  -- O7  = 1.6325 Angstrom
      mean = 1.5964 Angstrom
        t1 = 0.124577  (0.0 is a perfect SiO4 tetrahedron)
        t2 = 0.087205  (0.0 is a perfect tetrahedron)

[Si] Ideal SiO distance = 1.610 Angstrom
T3  -- O4  = 1.6884 Angstrom
T3  -- O7  = 1.6571 Angstrom
T3  -- O8  = 1.6720 Angstrom
T3  -- O9  = 1.6721 Angstrom
      mean = 1.6724 Angstrom
        t1 = 0.058152  (0.0 is a perfect SiO4 tetrahedron)
        t2 = 0.027477  (0.0 is a perfect tetrahedron)

[Si] Ideal SiO distance = 1.610 Angstrom
T4  -- O8  = 1.6433 Angstrom
T4  -- O10 = 1.6140 Angstrom
T4  -- O11 = 1.5870 Angstrom
T4  -- O12 = 1.5696 Angstrom
      mean = 1.6035 Angstrom
        t1 = 0.099182  (0.0 is a perfect SiO4 tetrahedron)
        t2 = 0.109304  (0.0 is a perfect tetrahedron)

[Si] Ideal SiO distance = 1.610 Angstrom
T5  -- O9  = 1.6382 Angstrom
T5  -- O12 = 1.5961 Angstrom
T5  -- O13 = 1.6233 Angstrom
T5  -- O14 = 1.5937 Angstrom
      mean = 1.6128 Angstrom
        t1 = 0.151453  (0.0 is a perfect SiO4 tetrahedron)
        t2 = 0.103166  (0.0 is a perfect tetrahedron)

        T-O SUMMARY
          Range  = 1.5687 A <--> 1.6884 A
          Mean   = 1.6179 A
          StdDev = 0.0374 A

       t1 Range  = 0.0582 <-- 0.1119 --> 0.1515
       t2 Range  = 0.0275 <-- 0.0895 --> 0.1201

-------------------------------------------------------------------
------------------------- O-T-O Analysis --------------------------
-------------------------------------------------------------------
O2  -- T1  -- O1  = 114.417 deg; O2  -- O1  = 3 A
O2  -- T1  -- O3  = 131.544 deg; O2  -- O3  = 3 A
O2  -- T1  -- O4  =  80.799 deg; O2  -- O4  = 2 A
O1  -- T1  -- O3  = 113.747 deg; O1  -- O3  = 3 A
O1  -- T1  -- O4  = 108.460 deg; O1  -- O4  = 3 A
O3  -- T1  -- O4  =  79.554 deg; O3  -- O4  = 2 A
       79.554 deg <-- 104.754 deg --> 131.544 deg

O3  -- T2  -- O6  = 130.657 deg; O3  -- O6  = 3 A
O3  -- T2  -- O5  = 114.646 deg; O3  -- O5  = 3 A
O3  -- T2  -- O7  =  80.374 deg; O3  -- O7  = 2 A
O6  -- T2  -- O5  = 114.640 deg; O6  -- O5  = 3 A
O6  -- T2  -- O7  =  82.113 deg; O6  -- O7  = 2 A
O5  -- T2  -- O7  = 108.725 deg; O5  -- O7  = 3 A
       80.374 deg <-- 105.193 deg --> 130.657 deg

O4  -- T3  -- O7  = 118.849 deg; O4  -- O7  = 3 A
O4  -- T3  -- O8  = 107.299 deg; O4  -- O8  = 3 A
O4  -- T3  -- O9  = 107.323 deg; O4  -- O9  = 3 A
O7  -- T3  -- O8  = 102.327 deg; O7  -- O8  = 3 A
O7  -- T3  -- O9  = 102.768 deg; O7  -- O9  = 3 A
O8  -- T3  -- O9  = 118.914 deg; O8  -- O9  = 3 A
       102.327 deg <-- 109.580 deg --> 118.914 deg

O8  -- T4  -- O10 = 110.296 deg; O8  -- O10 = 3 A
O8  -- T4  -- O11 =  85.366 deg; O8  -- O11 = 2 A
O8  -- T4  -- O12 =  88.140 deg; O8  -- O12 = 2 A
O10 -- T4  -- O11 = 114.555 deg; O10 -- O11 = 3 A
O10 -- T4  -- O12 = 114.454 deg; O10 -- O12 = 3 A
O11 -- T4  -- O12 = 129.688 deg; O11 -- O12 = 3 A
       85.366 deg <-- 107.083 deg --> 129.688 deg

O9  -- T5  -- O12 =  72.821 deg; O9  -- O12 = 2 A
O9  -- T5  -- O13 = 108.294 deg; O9  -- O13 = 3 A
O9  -- T5  -- O14 =  77.231 deg; O9  -- O14 = 2 A
O12 -- T5  -- O13 = 113.946 deg; O12 -- O13 = 3 A
O12 -- T5  -- O14 = 129.395 deg; O12 -- O14 = 3 A
O13 -- T5  -- O14 = 113.757 deg; O13 -- O14 = 3 A
       72.821 deg <-- 102.574 deg --> 129.395 deg

        O-T-O SUMMARY
          Range  = 72.8207 deg <--> 131.5436 deg
          Mean   = 105.2292 deg
          StdDev = 17.3322 deg

        O--O SUMMARY
          Range  = 1.9201 A <--> 2.8838 A
          Mean   = 2.5440 A
          StdDev = 0.3047 A

-------------------------------------------------------------------
------------------------- T-T-T Analysis --------------------------
-------------------------------------------------------------------
-------------------------------------------------------------------
------------------------- T-O-T Analysis --------------------------
-------------------------------------------------------------------
T1  -- O1  -- T1  = 168.495 deg ; T1  -- T1   3.2079 A

T1  -- O2  -- T1  = 134.329 deg ; T1  -- T1   2.9067 A

T1  -- O3  -- T2  = 142.929 deg ; T1  -- T2   2.9749 A

T1  -- O4  -- T3  = 143.780 deg ; T1  -- T3   3.1820 A

T2  -- O5  -- T2  = 171.915 deg ; T2  -- T2   3.1973 A

T2  -- O6  -- T2  = 135.346 deg ; T2  -- T2   2.9261 A

T2  -- O7  -- T3  = 143.333 deg ; T2  -- T3   3.1226 A

T3  -- O8  -- T4  = 144.662 deg ; T3  -- T4   3.1589 A

T3  -- O9  -- T5  = 139.902 deg ; T3  -- T5   3.1097 A

T4  -- O10 -- T4  = 170.795 deg ; T4  -- T4   3.2176 A

T4  -- O11 -- T4  = 133.745 deg ; T4  -- T4   2.9190 A

T4  -- O12 -- T5  = 135.532 deg ; T4  -- T5   2.9303 A

T5  -- O13 -- T5  = 172.993 deg ; T5  -- T5   3.2406 A

T5  -- O14 -- T5  = 133.451 deg ; T5  -- T5   2.9279 A


        T-O-T SUMMARY
          Range  = 133.4513° <--> 172.9933 deg
          Mean   = 147.9434 deg
          StdDev = 15.1421 deg

        T--T SUMMARY
          Range  = 2.9067 A <--> 3.2406 A
          Mean   = 3.0730 A
          StdDev = 0.1284 A

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

SOME OXYGEN ATOMS ARE TOO CLOSE TO EACH OTHER
O2  -- O4  = 2.0985 A
O2  -- O4  = 2.0985 A
O3  -- O4  = 2.0665 A
O3  -- O7  = 2.0664 A
O6  -- O7  = 2.1114 A
O6  -- O7  = 2.1114 A
O8  -- O11 = 2.1903 A
O8  -- O12 = 2.2353 A
O9  -- O12 = 1.9201 A
O9  -- O14 = 2.0173 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  = 2.9067 Angstrom
  T1  -- T2  = 2.9749 Angstrom
  T1  -- T3  = 3.1303 Angstrom
  T1  -- T1  = 3.2079 Angstrom
  T1  -- T3  = 3.1820 Angstrom
T2  has 5 neighboring T-atoms within 3.50 A, but only 4 bridging O-atoms
  T2  -- T1  = 2.9749 Angstrom
  T2  -- T2  = 3.1973 Angstrom
  T2  -- T2  = 2.9261 Angstrom
  T2  -- T3  = 3.1748 Angstrom
  T2  -- T3  = 3.1226 Angstrom
T3  has 8 neighboring T-atoms within 3.50 A, but only 4 bridging O-atoms
  T3  -- T1  = 3.1303 Angstrom
  T3  -- T1  = 3.1820 Angstrom
  T3  -- T2  = 3.1748 Angstrom
  T3  -- T2  = 3.1226 Angstrom
  T3  -- T4  = 3.1695 Angstrom
  T3  -- T4  = 3.1589 Angstrom
  T3  -- T5  = 3.0985 Angstrom
  T3  -- T5  = 3.1097 Angstrom
T4  has 5 neighboring T-atoms within 3.50 A, but only 4 bridging O-atoms
  T4  -- T3  = 3.1695 Angstrom
  T4  -- T3  = 3.1589 Angstrom
  T4  -- T4  = 2.9190 Angstrom
  T4  -- T5  = 2.9303 Angstrom
  T4  -- T4  = 3.2176 Angstrom
T5  has 5 neighboring T-atoms within 3.50 A, but only 4 bridging O-atoms
  T5  -- T3  = 3.0985 Angstrom
  T5  -- T3  = 3.1097 Angstrom
  T5  -- T4  = 2.9303 Angstrom
  T5  -- T5  = 3.2406 Angstrom
  T5  -- T5  = 2.9279 Angstrom

-------------------------------------------------------------------
---------------------- Topological Analysis -----------------------
-------------------------------------------------------------------
T1 (Si): multiplicity = 16
Coordination Sequence =
    1 4 9 19 35 52 72 100 131 163 201 244 290 340 393 451 515
TD10 = 787
Circuit symbol = 4.8_{3}.4.8_{3}.4_{2}.8_{4}
Weight = 27
Vertex symbol  = 4.8_{3}.4.8_{3}.4_{2}.8_{4}
Weight = 27

T2 (Si): multiplicity = 16
Coordination Sequence =
    1 4 9 19 35 52 72 100 131 163 201 244 290 340 393 451 515
TD10 = 787
Circuit symbol = 4.8_{3}.4.8_{3}.4_{2}.8_{4}
Weight = 27
Vertex symbol  = 4.8_{3}.4.8_{3}.4_{2}.8_{4}
Weight = 27

T3 (Si): multiplicity = 16
Coordination Sequence =
    1 4 8 18 32 52 74 100 128 162 204 244 286 340 396 450 512
TD10 = 783
Circuit symbol = 4_{2}.4_{2}.8_{4}.8_{4}.8_{4}.8_{4}
Weight = 29
Vertex symbol  = 4_{2}.4_{2}.8_{4}.8_{4}.8_{4}.8_{4}
Weight = 29

T4 (Si): multiplicity = 16
Coordination Sequence =
    1 4 9 19 35 52 72 100 131 163 201 244 290 340 393 451 515
TD10 = 787
Circuit symbol = 4.8_{3}.4.8_{3}.4_{2}.8_{4}
Weight = 27
Vertex symbol  = 4.8_{3}.4.8_{3}.4_{2}.8_{4}
Weight = 27

T5 (Si): multiplicity = 16
Coordination Sequence =
    1 4 9 19 35 52 72 100 131 163 201 244 290 340 393 451 515
TD10 = 787
Circuit symbol = 4.8_{3}.4.8_{3}.4_{2}.8_{4}
Weight = 27
Vertex symbol  = 4.8_{3}.4.8_{3}.4_{2}.8_{4}
Weight = 27

<TD10> = 786.200
Average ring size = 6.3333
