data_4300918
_journal_name_full  'Inorganic Chemistry'
_journal_year      2005
_publ_section_title
;
Size and Shape Selectivity of Host Networks Built
Based on the Tunable Secondary Building Units
;
loop_
_publ_author_name
  'Lah, Myoung Soo'
  'Moon, Dohyn'
_chemical_formula_sum  'C42 H40 Mn3 N9 O10'
_chemical_formula_weight  995.65
_symmetry_cell_setting  Tetragonal
_symmetry_space_group_name_H-M  'I 41/a'
loop_
_symmetry_equiv_pos_as_xyz
 'x, y, z'
 '-x+1/2, -y, z+1/2'
 '-y+3/4, x+1/4, z+1/4'
 'y+3/4, -x+3/4, z+3/4'
 'x+1/2, y+1/2, z+1/2'
 '-x+1, -y+1/2, z+1'
 '-y+5/4, x+3/4, z+3/4'
 'y+5/4, -x+5/4, z+5/4'
 '-x, -y, -z'
 'x-1/2, y, -z-1/2'
 'y-3/4, -x-1/4, -z-1/4'
 '-y-3/4, x-3/4, -z-3/4'
 '-x+1/2, -y+1/2, -z+1/2'
 'x, y+1/2, -z'
 'y-1/4, -x+1/4, -z+1/4'
 '-y-1/4, x-1/4, -z-1/4'
_cell_length_a  40.2119(19)
_cell_length_b  40.2119(19)
_cell_length_c  17.7703(12)
_cell_angle_alpha  90.00
_cell_angle_beta  90.00
_cell_angle_gamma  90.00
_cell_volume  28735(3)
_cell_formula_units_Z  16
_cell_measurement_temperature  173(2)
_exptl_crystal_density_diffrn  0.921
_diffrn_ambient_temperature  173(2)
loop_
_atom_site_label
_atom_site_type_symbol
_atom_site_fract_x
_atom_site_fract_y
_atom_site_fract_z
_atom_site_U_iso_or_equiv
_atom_site_adp_type
_atom_site_occupancy
_atom_site_symmetry_multiplicity
_atom_site_calc_flag
_atom_site_refinement_flags
_atom_site_disorder_assembly
_atom_site_disorder_group
Mn1A Mn 0.960467(9) 1.034535(11) 1.24957(2) 0.05528(13) Uani 1 1 d . . .
O1A O 0.95143(5) 1.07559(5) 1.29229(11) 0.0746(6) Uani 1 1 d . . .
O2A O 0.88479(4) 1.06586(4) 1.10732(9) 0.0486(4) Uani 1 1 d . . .
O3A O 0.96314(4) 0.99268(4) 1.19744(10) 0.0545(5) Uani 1 1 d . . .
N1A N 0.92433(5) 1.04010(5) 1.17891(11) 0.0460(5) Uani 1 1 d . . .
N2A N 0.91896(5) 1.01247(5) 1.13127(12) 0.0522(6) Uani 1 1 d . . .
N3A N 0.92916(6) 1.00828(8) 1.33812(14) 0.0821(8) Uani 1 1 d . . .
C1A C 0.92839(7) 1.09835(8) 1.27507(17) 0.0695(9) Uani 1 1 d . . .
C2A C 0.92591(9) 1.12581(10) 1.3208(2) 0.0965(12) Uani 1 1 d . . .
H2A H 0.9408 1.1281 1.3620 0.116 Uiso 1 1 calc R . .
C3A C 0.90274(11) 1.14973(10) 1.3088(2) 0.1171(14) Uani 1 1 d . . .
H3A H 0.9018 1.1683 1.3417 0.140 Uiso 1 1 calc R . .
C4A C 0.88031(9) 1.14773(8) 1.2495(2) 0.1044(13) Uani 1 1 d . . .
H4A H 0.8639 1.1644 1.2421 0.125 Uiso 1 1 calc R . .
C5A C 0.88277(7) 1.12036(7) 1.20111(18) 0.0688(9) Uani 1 1 d . . .
H5A H 0.8683 1.1189 1.1589 0.083 Uiso 1 1 calc R . .
C6A C 0.90564(7) 1.09553(7) 1.21339(16) 0.0559(7) Uani 1 1 d . . .
C7A C 0.90506(6) 1.06588(7) 1.16281(15) 0.0466(7) Uani 1 1 d . . .
C8A C 0.94005(6) 0.98925(7) 1.14568(16) 0.0523(7) Uani 1 1 d . . .
C9A C 0.93824(7) 0.95735(7) 1.10397(18) 0.0785(9) Uani 1 1 d . . .
H9A1 H 0.9566 0.9561 1.0678 0.118 Uiso 1 1 calc R . .
H9A2 H 0.9170 0.9560 1.0770 0.118 Uiso 1 1 calc R . .
H9A3 H 0.9399 0.9388 1.1395 0.118 Uiso 1 1 calc R . .
C10A C 0.89900(9) 1.01886(10) 1.35706(19) 0.1011(12) Uani 1 1 d . . .
H10A H 0.8912 1.0395 1.3377 0.121 Uiso 1 1 calc R . .
C11A C 0.87848(9) 1.00033(13) 1.4049(2) 0.1381(18) Uani 1 1 d . . .
H11A H 0.8569 1.0087 1.4161 0.166 Uiso 1 1 calc R . .
C12A C 0.88738(12) 0.97253(16) 1.4343(3) 0.163(2) Uani 1 1 d . . .
C13A C 0.91914(13) 0.96080(14) 1.4145(3) 0.189(3) Uani 1 1 d . . .
H13A H 0.9271 0.9403 1.4341 0.227 Uiso 1 1 calc R . .
C14A C 0.93898(9) 0.97982(12) 1.3651(2) 0.1212(15) Uani 1 1 d . . .
H14A H 0.9602 0.9716 1.3511 0.145 Uiso 1 1 calc R . .
C15A C 0.86184(14) 0.95552(19) 1.4868(4) 0.269(5) Uani 1 1 d . . .
H15C H 0.8463 0.9725 1.5066 0.322 Uiso 1 1 calc R . .
H15D H 0.8487 0.9392 1.4574 0.322 Uiso 1 1 calc R . .
Mn1B Mn 0.886518(9) 1.028520(9) 1.03526(2) 0.04548(11) Uani 1 1 d . . .
O1B O 0.84850(4) 1.00817(4) 1.07062(9) 0.0517(4) Uani 1 1 d . . .
O2B O 0.88346(4) 0.94671(4) 0.89260(10) 0.0620(5) Uani 1 1 d . . .
O3B O 0.92741(4) 1.04357(4) 0.98982(10) 0.0565(5) Uani 1 1 d . . .
N1B N 0.89339(4) 0.99306(5) 0.96271(11) 0.0441(5) Uani 1 1 d . . .
N2B N 0.92364(5) 0.99472(5) 0.92302(12) 0.0542(6) Uani 1 1 d . . .
N3B N 0.85755(5) 1.05947(5) 0.94981(14) 0.0597(6) Uani 1 1 d . . .
C1B C 0.83106(6) 0.98287(6) 1.04097(15) 0.0466(6) Uani 1 1 d . . .
C2B C 0.80020(6) 0.97576(6) 1.07271(15) 0.0570(7) Uani 1 1 d . . .
H2B H 0.7928 0.9883 1.1148 0.068 Uiso 1 1 calc R . .
C3B C 0.78030(7) 0.95114(7) 1.04461(16) 0.0636(8) Uani 1 1 d . . .
H3B H 0.7591 0.9473 1.0664 0.076 Uiso 1 1 calc R . .
C4B C 0.79055(6) 0.93197(6) 0.98570(15) 0.0545(7) Uani 1 1 d . . .
H4B H 0.7767 0.9147 0.9671 0.065 Uiso 1 1 calc R . .
C5B C 0.82089(6) 0.93785(6) 0.95361(14) 0.0475(7) Uani 1 1 d . . .
H5B H 0.8280 0.9244 0.9126 0.057 Uiso 1 1 calc R . .
C6B C 0.84194(6) 0.96344(6) 0.98011(14) 0.0426(6) Uani 1 1 d . . .
C7B C 0.87404(6) 0.96768(6) 0.94345(15) 0.0467(7) Uani 1 1 d . . .
C8B C 0.93894(7) 1.02207(7) 0.94336(17) 0.0615(8) Uani 1 1 d . . .
C9B C 0.97396(7) 1.02872(8) 0.91297(19) 0.0984(12) Uani 1 1 d . . .
H9B1 H 0.9798 1.0116 0.8760 0.148 Uiso 1 1 calc R . .
H9B2 H 0.9900 1.0282 0.9546 0.148 Uiso 1 1 calc R . .
H9B3 H 0.9746 1.0507 0.8890 0.148 Uiso 1 1 calc R . .
C10B C 0.83430(8) 1.08020(7) 0.97103(17) 0.0750(9) Uani 1 1 d . . .
H10B H 0.8292 1.0817 1.0231 0.090 Uiso 1 1 calc R . .
C11B C 0.81720(10) 1.09966(10) 0.9222(2) 0.1259(16) Uani 1 1 d . . .
H11B H 0.7996 1.1134 0.9398 0.151 Uiso 1 1 calc R . .
C12B C 0.82537(12) 1.09943(11) 0.8472(3) 0.1447(19) Uani 1 1 d . . .
C13B C 0.84936(11) 1.07710(11) 0.8247(2) 0.1423(19) Uani 1 1 d . . .
H13B H 0.8554 1.0755 0.7732 0.171 Uiso 1 1 calc R . .
C14B C 0.86430(9) 1.05729(8) 0.87682(19) 0.0946(12) Uani 1 1 d . . .
H14B H 0.8801 1.0413 0.8604 0.114 Uiso 1 1 calc R . .
C15B C 0.80893(17) 1.12538(14) 0.7903(3) 0.191(3) Uani 1 1 d . . .
H15A H 0.7928 1.1393 0.8182 0.229 Uiso 1 1 calc R . .
H15B H 0.8265 1.1402 0.7704 0.229 Uiso 1 1 calc R . .
Mn1C Mn 0.924312(9) 0.955473(10) 0.83386(3) 0.05953(14) Uani 1 1 d . . .
O1C O 0.90173(4) 0.98294(5) 0.76704(13) 0.0750(6) Uani 1 1 d . . .
O2C O 1.00132(4) 0.97803(5) 0.68671(9) 0.0707(6) Uani 1 1 d . . .
O3C O 0.95445(4) 0.92943(4) 0.89562(10) 0.0610(5) Uani 1 1 d . . .
O4C O 0.91292(5) 0.90834(6) 0.77211(17) 0.1037(10) Uani 1 1 d . . .
N1C N 0.96546(5) 0.96280(5) 0.77991(13) 0.0514(6) Uani 1 1 d . . .
N2C N 0.99381(5) 0.94759(5) 0.81250(12) 0.0490(5) Uani 1 1 d . . .
N3C N 0.90420(17) 0.85333(15) 0.7607(6) 0.280(4) Uani 1 1 d . . .
C1C C 0.91220(8) 0.99717(9) 0.7065(2) 0.0789(10) Uani 1 1 d . . .
C2C C 0.88929(10) 1.01680(11) 0.6673(3) 0.1140(14) Uani 1 1 d . . .
H2C H 0.8676 1.0198 0.6876 0.137 Uiso 1 1 calc R . .
C3C C 0.89715(13) 1.03158(13) 0.6014(4) 0.158(2) Uani 1 1 d . . .
H3C H 0.8809 1.0446 0.5762 0.190 Uiso 1 1 calc R . .
C4C C 0.92883(13) 1.02800(12) 0.5694(3) 0.1465(18) Uani 1 1 d . . .
H4C H 0.9339 1.0375 0.5218 0.176 Uiso 1 1 calc R . .
C5C C 0.95254(9) 1.01016(11) 0.6095(2) 0.1167(14) Uani 1 1 d . . .
H5C H 0.9745 1.0087 0.5901 0.140 Uiso 1 1 calc R . .
C6C C 0.94523(8) 0.99454(8) 0.6768(2) 0.0786(9) Uani 1 1 d . . .
C7C C 0.97203(7) 0.97778(7) 0.71649(17) 0.0595(8) Uani 1 1 d . . .
C8C C 0.98574(6) 0.93068(6) 0.87195(16) 0.0478(7) Uani 1 1 d . . .
C9C C 1.01035(6) 0.91148(6) 0.91519(15) 0.0629(8) Uani 1 1 d . . .
H9C1 H 1.0156 0.9232 0.9620 0.094 Uiso 1 1 calc R . .
H9C2 H 1.0307 0.9089 0.8853 0.094 Uiso 1 1 calc R . .
H9C3 H 1.0012 0.8895 0.9270 0.094 Uiso 1 1 calc R . .
C10C C 0.91502(15) 0.88329(13) 0.7918(4) 0.193(3) Uani 1 1 d . . .
H10C H 0.9262 0.8811 0.8386 0.231 Uiso 1 1 calc R . .
C11C C 0.88542(17) 0.8465(3) 0.7171(7) 0.440(12) Uani 1 1 d . . .
H11C H 0.8892 0.8596 0.6716 0.659 Uiso 1 1 calc R . .
H11D H 0.8630 0.8509 0.7364 0.659 Uiso 1 1 calc R . .
H11E H 0.8875 0.8228 0.7052 0.659 Uiso 1 1 calc R . .
C12C C 0.9143(4) 0.8191(2) 0.8090(6) 0.524(12) Uani 1 1 d . . .
H12A H 0.8982 0.8158 0.8497 0.786 Uiso 1 1 calc R . .
H12B H 0.9366 0.8217 0.8304 0.786 Uiso 1 1 calc R . .
H12C H 0.9140 0.7999 0.7753 0.786 Uiso 1 1 calc R . .
loop_
_atom_site_aniso_label
_atom_site_aniso_U_11
_atom_site_aniso_U_22
_atom_site_aniso_U_33
_atom_site_aniso_U_23
_atom_site_aniso_U_13
_atom_site_aniso_U_12
Mn1A 0.0389(2) 0.0807(3) 0.0463(3) -0.0020(2) 0.0019(2) -0.0067(2)
O1A 0.0600(13) 0.0976(16) 0.0662(14) -0.0317(12) -0.0066(11) 0.0029(12)
O2A 0.0427(10) 0.0461(10) 0.0572(12) -0.0031(9) -0.0053(9) 0.0045(8)
O3A 0.0401(10) 0.0645(12) 0.0590(12) 0.0081(10) -0.0048(9) 0.0032(9)
N1A 0.0364(12) 0.0516(13) 0.0501(14) -0.0093(12) 0.0004(10) -0.0016(11)
N2A 0.0441(13) 0.0483(14) 0.0641(16) -0.0066(12) -0.0113(11) 0.0024(11)
N3A 0.0532(17) 0.125(2) 0.0681(19) 0.0321(18) 0.0150(14) -0.0049(16)
C1A 0.057(2) 0.089(2) 0.063(2) -0.0287(19) 0.0029(17) -0.0014(18)
C2A 0.084(3) 0.117(3) 0.089(3) -0.058(2) -0.022(2) 0.010(2)
C3A 0.113(3) 0.117(3) 0.122(4) -0.073(3) -0.017(3) 0.014(3)
C4A 0.087(3) 0.076(2) 0.150(4) -0.045(3) -0.002(3) 0.018(2)
C5A 0.0558(19) 0.0588(19) 0.092(2) -0.0231(18) 0.0004(17) -0.0038(16)
C6A 0.0498(17) 0.0531(18) 0.065(2) -0.0181(16) 0.0050(16) -0.0084(15)
C7A 0.0352(15) 0.0553(18) 0.0492(18) -0.0037(15) 0.0052(14) -0.0092(13)
C8A 0.0389(16) 0.0539(18) 0.064(2) 0.0021(15) -0.0055(15) 0.0005(14)
C9A 0.071(2) 0.0558(19) 0.109(3) -0.0065(19) -0.0214(19) 0.0078(16)
C10A 0.070(2) 0.150(3) 0.083(3) 0.036(2) 0.026(2) 0.003(2)
C11A 0.072(3) 0.214(5) 0.128(4) 0.082(4) 0.040(3) 0.007(3)
C12A 0.098(4) 0.245(6) 0.148(4) 0.126(4) 0.057(3) 0.022(4)
C13A 0.140(4) 0.237(6) 0.191(5) 0.139(5) 0.058(4) 0.026(4)
C14A 0.080(3) 0.164(4) 0.120(3) 0.067(3) 0.030(2) 0.009(3)
C15A 0.136(5) 0.371(10) 0.299(9) 0.249(8) -0.049(5) -0.065(5)
Mn1B 0.0374(2) 0.0425(2) 0.0566(3) -0.0058(2) -0.0022(2) -0.00002(18)
O1B 0.0418(10) 0.0575(11) 0.0558(12) -0.0117(9) 0.0007(9) -0.0093(9)
O2B 0.0440(11) 0.0561(11) 0.0858(14) -0.0304(11) 0.0160(10) -0.0130(9)
O3B 0.0505(11) 0.0458(11) 0.0732(13) -0.0180(10) 0.0091(10) -0.0078(9)
N1B 0.0283(11) 0.0435(12) 0.0605(14) -0.0088(11) 0.0012(10) -0.0014(10)
N2B 0.0376(12) 0.0482(13) 0.0767(16) -0.0219(12) 0.0149(12) -0.0150(10)
N3B 0.0654(15) 0.0587(15) 0.0551(17) -0.0055(13) -0.0066(13) 0.0206(12)
C1B 0.0395(15) 0.0501(16) 0.0503(18) -0.0050(14) -0.0013(14) -0.0021(13)
C2B 0.0471(17) 0.0615(18) 0.062(2) -0.0162(15) 0.0141(15) -0.0147(14)
C3B 0.0482(17) 0.074(2) 0.068(2) -0.0042(18) 0.0102(16) -0.0103(16)
C4B 0.0434(16) 0.0555(17) 0.065(2) -0.0074(15) 0.0028(15) -0.0127(14)
C5B 0.0381(15) 0.0485(16) 0.0559(18) -0.0098(13) -0.0016(13) -0.0077(13)
C6B 0.0327(14) 0.0465(15) 0.0487(17) -0.0058(13) -0.0009(12) 0.0002(12)
C7B 0.0323(14) 0.0441(16) 0.0638(19) -0.0032(14) -0.0015(13) 0.0025(13)
C8B 0.0446(17) 0.064(2) 0.076(2) -0.0159(17) 0.0107(15) -0.0053(15)
C9B 0.077(2) 0.087(2) 0.131(3) -0.041(2) 0.046(2) -0.0363(19)
C10B 0.092(2) 0.080(2) 0.052(2) -0.0066(17) -0.0157(18) 0.0435(19)
C11B 0.176(4) 0.144(3) 0.058(3) -0.016(2) -0.016(3) 0.108(3)
C12B 0.188(4) 0.161(4) 0.085(3) 0.008(3) -0.039(3) 0.122(4)
C13B 0.194(4) 0.176(4) 0.057(3) 0.011(3) 0.005(3) 0.122(4)
C14B 0.124(3) 0.110(3) 0.050(2) 0.005(2) -0.001(2) 0.065(2)
C15B 0.270(7) 0.199(6) 0.102(4) -0.011(4) -0.017(4) 0.116(5)
Mn1C 0.0379(2) 0.0578(3) 0.0829(3) -0.0204(2) 0.0085(2) -0.0071(2)
O1C 0.0393(11) 0.0888(16) 0.0968(18) -0.0102(14) -0.0026(12) -0.0040(10)
O2C 0.0494(12) 0.1179(17) 0.0449(12) 0.0081(11) 0.0024(10) -0.0068(11)
O3C 0.0501(11) 0.0544(11) 0.0785(14) -0.0043(10) 0.0218(10) -0.0063(9)
O4C 0.0573(13) 0.0821(17) 0.172(3) -0.070(2) 0.0118(14) -0.0157(13)
N1C 0.0340(12) 0.0627(15) 0.0576(15) -0.0074(13) -0.0050(12) -0.0073(11)
N2C 0.0391(13) 0.0579(14) 0.0500(15) -0.0020(12) 0.0001(11) -0.0062(11)
N3C 0.229(6) 0.148(5) 0.464(11) -0.179(6) 0.187(7) -0.093(4)
C1C 0.046(2) 0.094(3) 0.097(3) -0.010(2) -0.023(2) -0.0009(19)
C2C 0.078(3) 0.137(4) 0.127(4) 0.007(3) -0.026(3) 0.017(3)
C3C 0.096(4) 0.204(5) 0.175(5) 0.058(4) -0.049(4) 0.011(4)
C4C 0.112(4) 0.190(5) 0.138(4) 0.080(4) -0.039(3) 0.000(3)
C5C 0.076(3) 0.181(4) 0.093(3) 0.029(3) -0.032(2) -0.002(3)
C6C 0.065(2) 0.098(3) 0.073(3) 0.012(2) -0.017(2) -0.0132(19)
C7C 0.0500(19) 0.085(2) 0.0433(19) -0.0034(17) -0.0106(17) -0.0054(16)
C8C 0.0387(16) 0.0448(16) 0.060(2) -0.0115(15) 0.0111(15) -0.0046(13)
C9C 0.0581(18) 0.0623(18) 0.068(2) 0.0061(16) 0.0049(16) -0.0050(15)
C10C 0.255(7) 0.116(4) 0.208(6) -0.111(5) 0.092(5) -0.089(5)
C11C 0.127(5) 0.467(16) 0.72(2) -0.505(18) -0.186(9) 0.119(7)
C12C 0.92(4) 0.175(8) 0.475(17) -0.140(10) 0.218(19) -0.259(13)
loop_
_geom_bond_atom_site_label_1
_geom_bond_atom_site_label_2
_geom_bond_distance
_geom_bond_site_symmetry_2
_geom_bond_publ_flag
Mn1A O1A 1.853(2) . ?
Mn1A O3A 1.9242(17) . ?
Mn1A N1A 1.933(2) . ?
Mn1A O2C 1.9746(18) 9_777 ?
Mn1A N2C 2.261(2) 9_777 ?
Mn1A N3A 2.275(2) . ?
O1A C1A 1.338(3) . ?
O2A C7A 1.279(3) . ?
O2A Mn1B 1.9745(16) . ?
O3A C8A 1.314(3) . ?
N1A C7A 1.326(3) . ?
N1A N2A 1.413(2) . ?
N2A C8A 1.287(3) . ?
N2A Mn1B 2.243(2) . ?
N3A C14A 1.302(4) . ?
N3A C10A 1.329(4) . ?
C1A C2A 1.375(4) . ?
C1A C6A 1.432(4) . ?
C2A C3A 1.356(4) . ?
C3A C4A 1.389(5) . ?
C4A C5A 1.400(4) . ?
C5A C6A 1.375(3) . ?
C6A C7A 1.493(3) . ?
C8A C9A 1.483(3) . ?
C10A C11A 1.399(4) . ?
C11A C12A 1.285(5) . ?
C12A C13A 1.406(6) . ?
C12A C15A 1.547(6) . ?
C13A C14A 1.412(5) . ?
C15A C15B 1.240(6) 4_465 ?
Mn1B O1B 1.8444(16) . ?
Mn1B O3B 1.9292(17) . ?
Mn1B N1B 1.9422(19) . ?
Mn1B N3B 2.283(2) . ?
O1B C1B 1.343(3) . ?
O2B C7B 1.293(3) . ?
O2B Mn1C 1.9781(16) . ?
O3B C8B 1.282(3) . ?
N1B C7B 1.328(3) . ?
N1B N2B 1.408(2) . ?
N2B C8B 1.311(3) . ?
N2B Mn1C 2.237(2) . ?
N3B C10B 1.308(3) . ?
N3B C14B 1.328(3) . ?
C1B C2B 1.393(3) . ?
C1B C6B 1.404(3) . ?
C2B C3B 1.368(3) . ?
C3B C4B 1.364(3) . ?
C4B C5B 1.368(3) . ?
C5B C6B 1.413(3) . ?
C6B C7B 1.456(3) . ?
C8B C9B 1.532(3) . ?
C10B C11B 1.355(4) . ?
C11B C12B 1.374(5) . ?
C12B C13B 1.377(5) . ?
C12B C15B 1.596(5) . ?
C13B C14B 1.361(4) . ?
C15B C15A 1.240(6) 3_654 ?
Mn1C O1C 1.859(2) . ?
Mn1C N1C 1.935(2) . ?
Mn1C O3C 1.9419(18) . ?
Mn1C O4C 2.238(2) . ?
O1C C1C 1.289(4) . ?
O2C C7C 1.291(3) . ?
O2C Mn1A 1.9746(18) 9_777 ?
O3C C8C 1.328(3) . ?
O4C C10C 1.069(6) . ?
N1C C7C 1.305(3) . ?
N1C N2C 1.417(3) . ?
N2C C8C 1.297(3) . ?
N2C Mn1A 2.261(2) 9_777 ?
N3C C11C 1.117(11) . ?
N3C C10C 1.394(5) . ?
N3C C12C 1.671(14) . ?
C1C C2C 1.399(5) . ?
C1C C6C 1.433(4) . ?
C2C C3C 1.352(5) . ?
C3C C4C 1.402(6) . ?
C4C C5C 1.390(5) . ?
C5C C6C 1.382(4) . ?
C6C C7C 1.453(4) . ?
C8C C9C 1.472(3) . ?