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

Report for the framework in file "public/tmp/tmp_194_6_101366728_mQ7OCS.cif"

There are 144 T-atoms per unit cell
There are 288 O-atoms per unit cell

Framework density = 21.42 T-atoms per nm^3
Material density = 2.137 grams per cm^3 (excluding extra-framework material)
-------------------------------------------------------------------
-------------------------- T-O Analysis ---------------------------
-------------------------------------------------------------------
[Si] Ideal SiO distance = 1.610 Angstrom
T1  -- O1  = 1.5710 Angstrom
T1  -- O2  = 1.5887 Angstrom
T1  -- O3  = 1.6392 Angstrom
T1  -- O4  = 1.5356 Angstrom
      mean = 1.5836 Angstrom
        t1 = 0.081126  (0.0 is a perfect SiO4 tetrahedron)
        t2 = 0.079835  (0.0 is a perfect tetrahedron)

[Si] Ideal SiO distance = 1.610 Angstrom
T2  -- O3  = 1.6265 Angstrom
T2  -- O5  = 1.6942 Angstrom
T2  -- O6  = 1.7252 Angstrom
T2  -- O7  = 1.7678 Angstrom
      mean = 1.7035 Angstrom
        t1 = 0.083083  (0.0 is a perfect SiO4 tetrahedron)
        t2 = 0.044618  (0.0 is a perfect tetrahedron)

[Si] Ideal SiO distance = 1.610 Angstrom
T3  -- O4  = 1.5877 Angstrom
T3  -- O7  = 1.7940 Angstrom
T3  -- O8  = 1.6140 Angstrom
T3  -- O9  = 1.6282 Angstrom
      mean = 1.6560 Angstrom
        t1 = 0.112750  (0.0 is a perfect SiO4 tetrahedron)
        t2 = 0.100876  (0.0 is a perfect tetrahedron)

[Si] Ideal SiO distance = 1.610 Angstrom
T4  -- O9  = 1.6700 Angstrom
T4  -- O10 = 1.7174 Angstrom
T4  -- O11 = 1.6569 Angstrom
T4  -- O12 = 1.7102 Angstrom
      mean = 1.6886 Angstrom
        t1 = 0.078846  (0.0 is a perfect SiO4 tetrahedron)
        t2 = 0.042692  (0.0 is a perfect tetrahedron)

[Si] Ideal SiO distance = 1.610 Angstrom
T5  -- O13 = 1.5766 Angstrom
T5  -- O14 = 1.6871 Angstrom
T5  -- O12 = 1.6909 Angstrom
T5  -- O15 = 1.6264 Angstrom
      mean = 1.6453 Angstrom
        t1 = 0.136417  (0.0 is a perfect SiO4 tetrahedron)
        t2 = 0.106763  (0.0 is a perfect tetrahedron)

[Si] Ideal SiO distance = 1.610 Angstrom
T6  -- O15 = 1.5865 Angstrom
T6  -- O16 = 1.5483 Angstrom
T6  -- O17 = 1.6517 Angstrom
T6  -- O18 = 1.6114 Angstrom
      mean = 1.5995 Angstrom
        t1 = 0.083006  (0.0 is a perfect SiO4 tetrahedron)
        t2 = 0.082629  (0.0 is a perfect tetrahedron)

        T-O SUMMARY
          Range  = 1.5356 A <--> 1.7940 A
          Mean   = 1.6461 A
          StdDev = 0.0661 A

       t1 Range  = 0.0788 <-- 0.0959 --> 0.1364
       t2 Range  = 0.0427 <-- 0.0762 --> 0.1068

-------------------------------------------------------------------
------------------------- O-T-O Analysis --------------------------
-------------------------------------------------------------------
O1  -- T1  -- O2  = 110.130 deg; O1  -- O2  = 3 A
O1  -- T1  -- O3  = 123.021 deg; O1  -- O3  = 3 A
O1  -- T1  -- O4  =  87.655 deg; O1  -- O4  = 2 A
O2  -- T1  -- O3  = 112.078 deg; O2  -- O3  = 3 A
O2  -- T1  -- O4  = 110.680 deg; O2  -- O4  = 3 A
O3  -- T1  -- O4  = 110.559 deg; O3  -- O4  = 3 A
       87.655 deg <-- 109.021 deg --> 123.021 deg

O3  -- T2  -- O5  = 110.972 deg; O3  -- O5  = 3 A
O3  -- T2  -- O6  = 105.426 deg; O3  -- O6  = 3 A
O3  -- T2  -- O7  =  95.256 deg; O3  -- O7  = 3 A
O5  -- T2  -- O6  = 112.424 deg; O5  -- O6  = 3 A
O5  -- T2  -- O7  = 109.820 deg; O5  -- O7  = 3 A
O6  -- T2  -- O7  = 121.243 deg; O6  -- O7  = 3 A
       95.256 deg <-- 109.190 deg --> 121.243 deg

O4  -- T3  -- O7  = 126.393 deg; O4  -- O7  = 3 A
O4  -- T3  -- O8  =  95.535 deg; O4  -- O8  = 2 A
O4  -- T3  -- O9  =  86.914 deg; O4  -- O9  = 2 A
O7  -- T3  -- O8  = 109.435 deg; O7  -- O8  = 3 A
O7  -- T3  -- O9  = 115.688 deg; O7  -- O9  = 3 A
O8  -- T3  -- O9  = 121.044 deg; O8  -- O9  = 3 A
       86.914 deg <-- 109.168 deg --> 126.393 deg

O9  -- T4  -- O10 = 100.287 deg; O9  -- O10 = 3 A
O9  -- T4  -- O11 = 116.511 deg; O9  -- O11 = 3 A
O9  -- T4  -- O12 = 107.306 deg; O9  -- O12 = 3 A
O10 -- T4  -- O11 = 103.212 deg; O10 -- O11 = 3 A
O10 -- T4  -- O12 = 128.333 deg; O10 -- O12 = 3 A
O11 -- T4  -- O12 = 102.171 deg; O11 -- O12 = 3 A
       100.287 deg <-- 109.636 deg --> 128.333 deg

O13 -- T5  -- O14 = 142.428 deg; O13 -- O14 = 3 A
O13 -- T5  -- O12 =  90.881 deg; O13 -- O12 = 2 A
O13 -- T5  -- O15 =  92.021 deg; O13 -- O15 = 2 A
O14 -- T5  -- O12 = 109.676 deg; O14 -- O12 = 3 A
O14 -- T5  -- O15 = 122.009 deg; O14 -- O15 = 3 A
O12 -- T5  -- O15 =  78.762 deg; O12 -- O15 = 2 A
       78.762 deg <-- 105.963 deg --> 142.428 deg

O15 -- T6  -- O16 =  86.795 deg; O15 -- O16 = 2 A
O15 -- T6  -- O17 = 123.681 deg; O15 -- O17 = 3 A
O15 -- T6  -- O18 = 111.197 deg; O15 -- O18 = 3 A
O16 -- T6  -- O17 = 108.233 deg; O16 -- O17 = 3 A
O16 -- T6  -- O18 = 111.170 deg; O16 -- O18 = 3 A
O17 -- T6  -- O18 = 112.470 deg; O17 -- O18 = 3 A
       86.795 deg <-- 108.924 deg --> 123.681 deg

        O-T-O SUMMARY
          Range  = 78.7618 deg <--> 142.4283 deg
          Mean   = 108.0425 deg
          StdDev = 13.2694 deg

        O--O SUMMARY
          Range  = 2.1053 A <--> 3.0901 A
          Mean   = 2.6515 A
          StdDev = 0.2634 A

-------------------------------------------------------------------
------------------------- T-T-T Analysis --------------------------
-------------------------------------------------------------------
-------------------------------------------------------------------
------------------------- T-O-T Analysis --------------------------
-------------------------------------------------------------------
T1  -- O1  -- T1  = 121.131 deg ; T1  -- T1   2.7364 A

T1  -- O2  -- T1  = 126.437 deg ; T1  -- T1   2.8366 A

T1  -- O3  -- T2  = 106.781 deg ; T1  -- T2   2.6215 A

T1  -- O4  -- T3  = 142.400 deg ; T1  -- T3   2.9566 A

T2  -- O5  -- T2  = 156.328 deg ; T2  -- T2   3.3164 A

T2  -- O6  -- T2  = 145.898 deg ; T2  -- T2   3.2987 A

T2  -- O7  -- T3  = 150.575 deg ; T2  -- T3   3.4450 A

T3  -- O8  -- T3  = 137.847 deg ; T3  -- T3   3.0120 A

T3  -- O9  -- T4  = 152.582 deg ; T3  -- T4   3.2043 A

T4  -- O10 -- T4  = 114.019 deg ; T4  -- T4   2.8810 A

T4  -- O11 -- T4  = 111.315 deg ; T4  -- T4   2.7363 A

T4  -- O12 -- T5  = 165.557 deg ; T4  -- T5   3.3741 A

T5  -- O13 -- T5  = 118.795 deg ; T5  -- T5   2.7141 A

T5  -- O14 -- T5  = 105.305 deg ; T5  -- T5   2.6822 A

T5  -- O15 -- T6  = 150.100 deg ; T5  -- T6   3.1042 A

T6  -- O16 -- T6  = 155.379 deg ; T6  -- T6   3.0253 A

T6  -- O17 -- T6  = 109.819 deg ; T6  -- T6   2.7030 A

T6  -- O18 -- T6  = 110.787 deg ; T6  -- T6   2.6525 A


        T-O-T SUMMARY
          Range  = 105.3050° <--> 165.5572 deg
          Mean   = 132.2809 deg
          StdDev = 19.8277 deg

        T--T SUMMARY
          Range  = 2.6215 A <--> 3.4450 A
          Mean   = 2.9611 A
          StdDev = 0.2660 A

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

SOME OXYGEN ATOMS ARE TOO CLOSE TO EACH OTHER
O1  -- O4  = 2.1514 A
O1  -- O4  = 2.1514 A
O4  -- O9  = 2.2121 A
O12 -- O15 = 2.1053 A
O15 -- O16 = 2.1539 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  = 2.8366 Angstrom
  T1  -- T2  = 2.6215 Angstrom
  T1  -- T3  = 3.1326 Angstrom
  T1  -- T1  = 2.7364 Angstrom
  T1  -- T3  = 2.9566 Angstrom
T2  -- T1  = 2.6215 Angstrom
T3  has 5 neighboring T-atoms within 3.50 A, but only 4 bridging O-atoms
  T3  -- T1  = 3.1326 Angstrom
  T3  -- T2  = 3.4450 Angstrom
  T3  -- T3  = 3.0120 Angstrom
  T3  -- T4  = 3.2043 Angstrom
  T3  -- T1  = 2.9566 Angstrom
T4  -- T4  = 2.7363 Angstrom
T5  has 5 neighboring T-atoms within 3.50 A, but only 4 bridging O-atoms
  T5  -- T5  = 2.7141 Angstrom
  T5  -- T5  = 2.6822 Angstrom
  T5  -- T6  = 3.1169 Angstrom
  T5  -- T4  = 3.3741 Angstrom
  T5  -- T6  = 3.1042 Angstrom
T6  has 5 neighboring T-atoms within 3.50 A, but only 4 bridging O-atoms
  T6  -- T5  = 3.1169 Angstrom
  T6  -- T5  = 3.1042 Angstrom
  T6  -- T6  = 2.6525 Angstrom
  T6  -- T6  = 2.7030 Angstrom
  T6  -- T6  = 3.0253 Angstrom

-------------------------------------------------------------------
---------------------- Topological Analysis -----------------------
-------------------------------------------------------------------
T1 (Si): multiplicity = 24
Coordination Sequence =
    1 4 7 12 24 41 65 100 140 182 228 278 330 382 441 517 607
TD10 = 804
Circuit symbol = 4.4.4.4.4.6_{2}
Weight = 10
Vertex symbol  = 4.4.4.4.4.8_{2}
Weight = 18

T2 (Si): multiplicity = 24
Coordination Sequence =
    1 4 9 16 27 47 78 117 158 197 239 289 347 412 486 570 650
TD10 = 893
Circuit symbol = 4.6.4.8.4.8_{2}
Weight = 16
Vertex symbol  = 4.6.4.8.4.10_{3}
Weight = 25

T3 (Si): multiplicity = 24
Coordination Sequence =
    1 4 9 18 34 55 77 104 141 187 239 291 346 413 485 552 621
TD10 = 869
Circuit symbol = 4.8.4.8.4.8_{3}
Weight = 22
Vertex symbol  = 4.8.4.8.4.8_{3}
Weight = 22

T4 (Si): multiplicity = 24
Coordination Sequence =
    1 4 10 22 39 57 79 107 139 178 225 279 340 401 460 532 624
TD10 = 861
Circuit symbol = 4.8.4.8_{3}.6.8
Weight = 22
Vertex symbol  = 4.8.4.8_{3}.8.12_{6}
Weight = 37

T5 (Si): multiplicity = 24
Coordination Sequence =
    1 4 9 17 30 50 75 104 138 176 219 263 313 377 446 517 590
TD10 = 823
Circuit symbol = 4.4.4.8_{6}.6.6_{3}
Weight = 17
Vertex symbol  = 4.4.4.8_{3}.6_{2}.10
Weight = 22

T6 (Si): multiplicity = 24
Coordination Sequence =
    1 4 8 12 19 35 61 91 121 156 201 249 291 332 385 455 536
TD10 = 709
Circuit symbol = 4.4.4.6_{2}.4.6_{3}
Weight = 14
Vertex symbol  = 4.4.4.6.4.6_{2}
Weight = 14

<TD10> = 826.500
Average ring size = 5.8427
