A B X phase basis space group no R5- M2+ GM4+ X1- X5- M5+ X5+ M2- GM5+ complex modes largest second third POPs non-RUM POPs DOI PPN Cd Ag(CN)2 ambient (200)(020)(002) Pa -3 205 X5- (0,a;0,a;0,a) 205 Pa -3 M5+ (0,a;0,a;0,a) 206 Ia -3 M5+ (0,a;0,a;0,a) 206 Ia -3 X5- (0,a;0,a;0,a) 205 Pa -3 X5- 10.1021/jacs.5b13446 PPN Mn Au(CN)2 ambient (21-1)(011)(0-11) C2/c 15 R5- (a,b,-a) 15 C2/c GM4+ (0,a,a) 12 C2/m GM5+ (a,b,-a) 12 C2/m R5- (a,b,-a) 15 C2/c R5- 10.1021/jacs.5b13446 PPN Ni Au(CN)2 ambient (101)(01-1)(-222) R -3c 167 R5- (a,-a,a) 167 R -3c GM5+ (a,-a,a) 166 R -3m R5- (a,-a,a) 167 R -3c R5- 10.1016/j.poly.2006.10.045 FA Mn H2(PO)2 ambient (21-1)(011)(0-11) C2/c 15 R5- (a,b,b) 15 C2/c GM4+ (a,-a,0) 12 C2/m GM5+ (a,b,b) 12 C2/m R5- (a,b,b) 15 C2/c GM5+ (a,b,b) 12 C2/m R5- 10.1021/jacs.7b09417 Al H2(PO)2 ambient {21-1{011{0-11) C2/c 15 R5- (a,b,-a) 15 C2/c GM4+ (0,a,a) 12 C2/m GM5+ (a,b,-a) 12 C2/m R5- (a,b,b) 15 C2/c R5- 10.1039/C9CC00118B C(NH2)3 Mn H2(PO)2 ambient (200)(020)(-101) C2/m 12 R5- (a,b,0) 12 C2/m GM4+ (0,a,0) 83 P4/m GM5+ (0,0,a) 65 Cmmm R5- (a,b,0) 12 C2/m R4- (a,b,0) 12 C2/m R5- 10.1021/jacs.7b09417 V H2(PO)2 ambient {002}{110}{-110} P21/c 13 R5- (a,b,-b) 15 C2/c M2+ (a;0;0) 127 P4/mbm GM4+ (a,a,0) 12 C2/m X5- (0,0;0,0;a,-a) 63 Cmcm M5+ (a,-a;0,0;0,0) 53 Pmna GM5+ (a,b,-b) 12 C2/m R5- (a,b,-b) 15 C2/c M2+ (a;0;0) 127 P4/mbm M5+ (a,-a;0,0;0,0) 53 Pmna R5- M2+  10.1039/C9CC00118B Al H2(PO)2 ambient {200}{020}{-202} P21/c 13 M2+ (a;b;c) 71 Immm GM4+ (0,a,0) 83 P4/m M5+ (0,a;0,0;b,0) 72 Ibam X5+ (a,b;0,c;d,0) 14 P2_1/c GM5+ (0,0,a) 65 Cmmm X5+ (a,b;0,c;d,0) 14 P2_1/c M2+ (a;b;c) 71 Immm M5+ (0,a;0,0;b,0) 72 Ibam X5+ 10.1039/C9CC00118B Ga H2(PO)2 ambient {200}{020}{-202} P21/c 13 M2+ (a;b;c) 71 Immm GM4+ (0,a,0) 83 P4/m M5+ (0,a;0,0;b,0) 72 Ibam X5+ (a,b;0,c;d,0) 14 P2_1/c GM5+ (0,0,a) 65 Cmmm X5+ (a,b;0,c;d,0) 14 P2_1/c M2+ (a;b;c) 71 Immm M5+ (0,a;0,0;b,0) 72 Ibam X5+ 10.1039/C9CC00118B Ga H2(PO)2 0.7 GPa {200}{020}{-202} P21/c 13 M2+ (a;b;c) 71 Immm GM4+ (0,a,0) 83 P4/m M5+ (0,a;0,0;b,0) 72 Ibam X5+ (a,b;0,c;d,0) 14 P2_1/c GM5+ (0,0,a) 65 Cmmm M2+ (a;b;c) 71 Immm X5+ (a,b;0,c;d,0) 14 P2_1/c M5+ (0,a;0,0;b,0) 72 Ibam X5+ 10.1039/C9CC00118B Taz Mn H2(PO)2 ambient (110)(-110)(002) P2_1/c 13 R5- (a,b,b) 15 C2/c GM4+ (a,-a,0) 12 C2/m X5+ (0,0;0,0;a,a) 63 Cmcm M2- (a;0;0) 129 P4/nmm GM5+ (a,b,b) 12 C2/m X5+ (0,0;0,0;a,a) 63 Cmcm M2- (a;0;0) 129 P4/nmm R5- (a,b,b) 15 C2/c R5- M2-/X5+ 10.1021/jacs.7b09417 FA Mn H2(PO)2 115 K (110)(-110)(002) P2_1/c 13 R5- (a,b,b) 15 C2/c GM4+ (a,-a,0) 12 C2/m X5+ (0,0;0,0;a,a) 63 Cmcm M2- (a;0;0) 129 P4/nmm GM5+ (a,b,b) 12 C2/m R5- (a,b,b) 15 C2/c GM5+ (a,b,b) 12 C2/m GM4+ (a,-a,0) 12 C2/m R5- M2-/X5+ 10.1021/jacs.7b09417 (CH3)2NH2 Mn H2(PO)2 ambient (120)(002)(2-20) P2_1/c 13 M2+ (0;0;a) 127 P4/mbm GM4+ (0,0,a) 83 P4/m M5+ (0,0;0,0;0,a) 67 Cmma X5+ (0,a;0,0;b,c) 14 P2_1/c GM5+ (a,0,0) 65 Cmmm SM1, SM2, S3, S4, A2, B1 B1 (0,0;0,0;0,0;0,0;0,0;a,0;0,0;0,0;0,0;0,0;0,0;0,0) 12 C2/m M2+ (0;0;a) 127 P4/mbm S3 (0,0;0,0;0,0;0,0;0,a;0,0) 63 Cmcm S3 B1 10.1039/c8cc00907d HIm Mn H2(PO)2 ambient (110)(002)(2-20) P2_1/c 13 R5- (a,0,0) 140 I4/mcm GM4+ (0,0,a) 83 P4/m X5+ (0,0;0,0;a,b) 11 P2_1/m GM5+ (a,0,0) 65 Cmmm S1,S2,SM3,SM4 X5+ (0,0;0,0;a,b) 11 P2_1/m S2 (0,0;0,0;0,0;0,0;0,0;a,-a) 64 Cmca M5- (a,b;0,0;0,0) 10 P2/m, X5+ S2 10.1021/jacs.7b09417 DAB Mn H2(PO)2 120 K (110)(-112)(1-12) P -1 2 R5- (a,b,c) 2 P -1 M2+ (a;0;0) 127 P4/mbm GM4+ (a,b,c) 2 P -1 X1- (0;0;a) 124 P4/mcc X5- (0,0;0,0;a,b) 11 P2_1/m M5+ (a,b;0,0;0,0) 13 P2/c GM5+ (a,b,c) 2 P -1 LD1, LD2, LD3 M2+ (a;0;0) 127 P4/mbm LD1 (0,0;a,-a;b,-b;0,0) 10 P2/m LD3 (0,0,0,0;a,b,b,a;c,d,d,c;0,0,0,0) 2 P -1 LD1 M2+ 10.1021/jacs.7b09417 C(NH2)3 Mn H2(PO)2 ambient (101)(-110)(-1-21) P -1 2 R5- (a,b,c) 2 P -1 GM4+ (a,b,c) 2 P -1 GM5+ (a,b,c) 2 P -1 LD1, LD2, LD3 R5- (a,b,c) 2 P -1 LD3 (0,0,0,0;0,0,0,0;0,0,0,0;a,b,b,a) 2 P -1 R4- (a,b,c) 2 P -1 LD3 10.1021/jacs.7b09417 DAB Mn H2(PO)2 ambient (-110)(0-1-1)(-4-44) R -3 148 R5- (a,-a,-a) 167 R -3c GM4+ (a,a,-a) 148 R -3 GM5+ (a,-a,-a) 166 R -3m LD1, LD2 R5- (a,-a,-a) 167 R -3c LD1 (0,0;0,0;0,0;a,-a) 166 R -3m GM5+ (a,-a,-a) 166 R -3m LD1 R5- 10.1021/jacs.7b09417 (CH3)2NH2 Cu HCOO ambient (21-1)(011)(0-11) C2/c 15 R5- (a,b,-a) 15 C2/c GM4+ (0,a,a) 12 C2/m GM5+ (a,b,-a) 12 C2/m R5- (a,b,-a) 15 C2/c R5- 10.1107/S0567740873005480 K Co HCOO ambient (21-1)(011)(0-11) C2/c 15 R5- (a,b,-a) 15 C2/c GM4+ (0,a,a) 12 C2/m GM5+ (a,b,-a) 12 C2/m R5- (a,b,-a) 15 C2/c GM5+ (a,b,-a) 12 C2/m R5- 10.1039/c0dt01701a Rb Mn HCOO ambient (21-1)(011)(0-11) C2/c 15 R5- (a,b,b) 15 C2/c GM4+ (a,-a,0) 12 C2/m GM5+ (a,b,b) 12 C2/m R5- (a,b,b) 15 C2/c GM5+ (a,b,b) 12 C2/m R5- 10.1039/c5ce01628b K Cd HCOO ambient (21-1)(011)(0-11) C2/c 15 R5- (a,b,-a) 15 C2/c GM4+ (0,a,a) 12 C2/m GM5+ (a,b,-a) 12 C2/m R5- (a,b,-a) 15 C2/c GM5+ (a,b,-a) 12 C2/m R5- Koordinatsionnaya Khimiya (1983) 9 p855-p858 FA Mn HCOO 110 K (21-1)(011)(0-11) C2/c 15 R5- (a,b,-a) 15 C2/c GM4+ (0,a,a) 12 C2/m GM5+ (a,b,-a) 12 C2/m R5- (a,b,-a) 15 C2/c R5- 10.1021/ic500479e (CH3)2NH2 Mn HCOO 100 K (21-1)(011)(0-11) Cc 9 R5- (a,b,-a) 15 C2/c GM4+ (0,a,a) 12 C2/m GM5+ (a,b,-a) 12 C2/m R5- (a,b,-a) 15 C2/c R5- GM4- 10.1039/c3ce42411a NH4 Mn HCOO ambient (200)(020)(002) Im -3 204 M2+ (a;a;a) 204 Im -3 M2+ (a;a;a) 204 Im -3 M2+ 10.1039/c4ra02609h EtNH3 Mg HCOO 430 K (110)(002)(1-10) Imma 74 R5- (0,a,a) 74 Imma GM5+ (a,0,0) 65 Cmmm R5- (a,a,0) 74 Imma R5- 10.1002/chem.201303425 Ace Mn HCOO 330 K (110)(002)(1-10) Imma 74 R5- (0,a,a) 74 Imma GM5+ (a,0,0) 65 Cmmm R5- (0,a,a) 74 Imma R5- 10.1039/c7dt01251a (CH3)2NH2 Fe HCOO 7.9 GPa (002)(110)(-110) P1 1 R5- (a,b,c) 2 P -1 M2+ (a;0;0) 127 P4/mbm GM4+ (a,b,c) 2 P -1 X1- (0;0;a) 124 P4/mcc X5- (0,0;0,0;a,b) 11 P2_1/m M5+ (a,b;0,0;0,0) 13 P2/c X5+ (0,0;0,0;a,b) 11 P2_1/m M2- (a;0;0) 129 P4/nmm GM5+ (a,b,c) 2 P -1 R5- (a,b,c) 2 P -1 X5+ (0,0;0,0;a,b) 11 P2_1/m GM4+ (a,b,c) 2 P-1 - 10.1039/c8ce00617b MHy Mn HCOO 100 K (10-1)(01-1)(110) P1 1 R5- (a,b,c) 2 P -1 GM4+ (a,b,c) 2 P -1 GM5+ (a,b,c) 2 P -1 R5- (a,b,c) 2 P -1 R5- GM4- 10.1021/acs.chemmater.6b05249 CH3NH3 Co HCOO 45 K (110)(-110)(-1-12) P2_1/c 13 R5- (0,a,-a) 74 Imma M2+ (a;0;0) 127 P4/mbm GM4+ (a,-a,0) 12 C2/m X1- (0;0;a) 124 P4/mcc X5- (0,0;0,0;a,-a) 63 Cmcm M5+ (a,a;0,0;0,0) 53 Pmna GM5+ (a,b,b) 12 C2/m R5- (0,a,-a) 74 Imma M2+ (a;0;0) 127 P4/mbm R5- M2+ GM4+/GM5+/R2-/R3-/X1-/X4-/M5+ 10.1002/chem.201703140 HIm Mn HCOO ambient (200)(020)(-202) P2_1/c 13 R5- (0,0,a) 140 I4/mcm M2+ (a;0;0) 127 P4/mbm GM4+ (0,a,0) 83 P4/m X1- (0;0;a) 124 P4/mcc X5- (0,0;0,0;0,a) 51 Pmma M5+ (0,a;0,0;0,0) 67 Cmma X5+ (a,b;0,c;0,0) 14 P2_1/c GM5+ (0,0,a) 65 Cmmm M2+ (a;0;0) 127 P4/mbm R5- (0,0,a) 140 I4/mcm X5+ (a,b;0,c;0,0) 14 P2_1/c R5- X5+ 10.1107/S0108270113012638 Ace Mn HCOO 250 K (10-1)(020)(002) P2_1/c 13 R5- (a,b,0) 12 C2/m GM4+ (0,a,0) 83 P4/m X5+ (a,b;0,0;0,0) 11 P2_1/m M2- (0;a;0) 129 P4/nmm GM5+ (0,0,a) 65 Cmmm R5- (a,b,0) 12 C2/m R5- X5+ 10.1039/c7dt01251a Aze Mn HCOO 180 K (200)(020)(-202) P2_1/c 13 R5- (a,b,0) 12 C2/m M2+ (0;a;0) 127 P4/mbm GM4+ (0,a,0) 83 P4/m X5- (a,b;0,0;0,0) 11 P2_1/m X5+ (0,0;0,a;b,0) 59 Pmmn M2- (a;0;b) 72 Ibam GM5+ (0,0,a) 65 Cmmm R5- (a,b,0) 12 C2/m M2+ (0;a;0) 127 P4/mbm X5+ (0,0;0,a;b,0) 59 Pmmn R5- X5+/M2- 10.1039/B404466E HIm Mn HCOO 453 K (1-10)(110)(001) P -42_1m 113 M2+ (a;0;0) 127 P4/mbm M2+ (a;0;0) 127 P4/mbm M2+ GM5- 10.1107/S0108270113012638 C(NH2)3 Cu HCOO ambient (110)(-110)(002) Pna2_1 33 R5- (0,a,-a) 74 Imma M2+ (a;0;0) 127 P4/mbm X5- (0,0;0,0;a,-a) 63 Cmcm X5+ (0,0;0,0;a,a) 63 Cmcm GM5+ (a,0,0) 65 Cmmm R5- (0,a,-a) 74 Imma M3+ (a;0;0) 127 P4/mbm X5+ (0,0;0,0;a,a) 63 Cmcm R5-/X5- X5+ M2,3+ 10.1002/chem.200901605 NH2NH3 Mn HCOO 110 K (110)(-110)(002) Pna2_1 33 R5- (0,a,a) 74 Imma M2+ (a;0;0) 127 P4/mbm X5- (0,0;0,0;a,a) 63 Cmcm X5+ (0,0;0,0;a,-a) 63 Cmcm GM5+ (a,0,0) 65 Cmmm R5- (0,a,a) 74 Imma M2+ (a;0;0) 127 P4/mbm X5+ (0,0;0,0;a,-a) 63 Cmcm R5-/X5- X5+ M2,3+ 10.1039/c3qi00034f EtNH3 Mg HCOO ambient (110)(-110)(002) Pna2_1 33 R5- (0,a,-a) 74 Imma M2+ (a;0;0) 127 P4/mbm X5- (0,0;0,0;a,-a) 63 Cmcm X5+ (0,0;0,0;a,a) 63 Cmcm GM5+ (a,0,0) 65 Cmmm R5- (0,a,-a) 74 Imma M2+ (a;0;0) 127 P4/mbm X5+ (0,0;0,0;a,a) 63 Cmcm R5-/X5- X5+ M2,3+ 10.1002/chem.201303425 EtNH3 Mn HCOO ambient (110)(-110)(002) Pna2_1 33 R5- (0,a,a) 74 Imma M2+ (a;0;0) 127 P4/mbm X5- (0,0;0,0;a,a) 63 Cmcm X5+ (0,0;0,0;a,-a) 63 Cmcm GM5+ (a,0,0) 65 Cmmm R5- (0,a,a) 74 Imma M2+ (a;0;0) 127 P4/mbm X5+ (0,0;0,0;a,-a) 63 Cmcm R5-/X5- X5+ M2,3+ 10.1039/B404466E NH4 Cd HCOO ambient (110)(-110)(002) Pna2_1 33 R5- (0,a,a) 74 Imma M2+ (a;0;0) 127 P4/mbm X5- (0,0;0,0;a,a) 63 Cmcm X5+ (0,0;0,0;a,-a) 63 Cmcm GM5+ (a,0,0) 65 Cmmm X5- (0,0;0,0;a,a) 63 Cmcm X5+ (0,0;0,0;a,-a) 63 Cmcm M2+ (a;0;0) 127 P4/mbm R5-/X5- X5+ M2,3+ Koordinatsionnaya Khimiya (1983) 9 p855-p858 CH3NH3 Mn HCOO ambient (110)(002)(1-10) Pnma 62 R5- (0,a,a) 74 Imma M2+ (a;0;0) 127 P4/mbm X5- (0,0;0,0;a,a) 63 Cmcm GM5+ (a,0,0) 65 Cmmm R5- (0,a,a) 74 Imma M2+ (a;0;0) 127 P4/mbm R5- M2+ 10.1039/B404466E CH3NH3 Cu HCOO ambient (110)(002)(1-10) Pnma 62 R5- (0,a,a) 74 Imma M2+ (a;0;0) 127 P4/mbm X5- (0,0;0,0;a,a) 63 Cmcm GM5+ (a,0,0) 65 Cmmm R5- (0,a,a) 74 Imma M2+ (a;0;0) 127 P4/mbm R5- M2+ Koordinatsionnaya Khimiya (1990) 16, (*) p218-p224 NH2NH3 Mn HCOO 400 K (110)(002)(1-10) Pnma 62 R5- (0,a,a) 74 Imma M2+ (a;0;0) 127 P4/mbm X5- (0,0;0,0;a,a) 63 Cmcm GM5+ (a,0,0) 65 Cmmm R5- (0,a,a) 74 Imma M2+ (a;0;0) 127 P4/mbm R5- M2+ 10.1039/c3qi00034f Aze Mn HCOO ambient (110)(002)(1-10) Pnma 62 R5- (0,a,a) 74 Imma M2+ (a;0;0) 127 P4/mbm X5- (0,0;0,0;a,a) 63 Cmcm GM5+ (a,0,0) 65 Cmmm R5- (0,a,a) 74 Imma M2+ (a;0;0) 127 P4/mbm R5- M2+ 10.1039/B404466E N(CH3)4 Mn HCOO ambient (110)(002)(1-10) Pnma 62 R5- (0,a,a) 74 Imma M2+ (a;0;0) 127 P4/mbm X5- (0,0;0,0;a,a) 63 Cmcm GM5+ (a,0,0) 65 Cmmm R5- (0,a,a) 74 Imma M2+ (a;0;0) 127 P4/mbm R5- M2+ 10.1039/c4ra02609h, 10.1107/S1600536813024045 C(NH2)3 Mn HCOO ambient (110)(002)(1-10) Pnna 52 R5- (a,-a,0) 74 Imma X5+ (a,a;0,0;0,0) 63 Cmcm GM5+ (0,0,a) 65 Cmmm R5- (a,-a,0) 74 Imma X5+ (a,a;0,0;0,0) 63 Cmcm R5- X5+ 10.1002/chem.200901605 MHy Mn HCOO 230 K (101)(01-1)(-222) R3c 161 R5- (a,-a,a) 167 R -3c GM5+ (a,-a,a) 166 R -3m R5- (a,-a,a) 167 R -3c R5- GM4- 10.1021/acs.chemmater.6b05249 EtNH3 Mg HCOO 378 K (101)(01-1)(-222) R -3 148 R5- (a,-a,a) 167 R -3c GM4+ (a,-a,-a) 148 R -3 GM5+ (a,-a,a) 166 R -3m R5- (a,-a,a) 167 R -3c R5- GM4+/R2-/R4- 10.1002/chem.201303425 (CH3)2NH2 Mn HCOO ambient (101)(01-1)(-222) R -3c 167 R5- (a,-a,a) 167 R -3c GM5+ (a,-a,a) 166 R -3m R5- (a,-a,a) 167 R -3c R5- 10.1021/ic0498081 C(NH2)3 Mn HCOO 1.61 GPa (101)(01-1)(-222) R -3c 167 R5- (a,-a,a) 167 R -3c GM5+ (a,-a,a) 166 R -3m R5- (a,-a,a) 167 R -3c R5- 10.1039/c8ce01612g, 10.1098/rsta.2018.0227 C(NH2)3 Cd HCOO ambient (101)(01-1)(-222) R -3c 167 R5- (a,-a,a) 167 R -3c GM5+ (a,-a,a) 166 R -3m R5- (a,-a,a) 167 R -3c R5- 10.1039/c5dt03263f FA Mn HCOO 355 K (101)(01-1)(-222) R -3c 167 R5- (a,-a,a) 167 R -3c GM5+ (a,-a,a) 166 R -3m R5- (a,-a,a) 167 R -3c R5- 10.1021/ic500479e MHy Mn HCOO 330 K (101)(01-1)(-222) R -3c 167 R5- (a,-a,a) 167 R -3c GM5+ (a,-a,a) 166 R -3m R5- (a,-a,a) 167 R -3c R5- 10.1021/acs.chemmater.6b05249 Et3P(CH2)2F Mn N(CN)2 ambient (21-1)(011)(0-11) C2/c 15 R5- (a,b,-a) 15 C2/c GM4+ (0,a,a) 12 C2/m GM5+ (a,b,-a) 12 C2/m R5- (a,b,-a) 15 C2/c R4- (a,0,a) 74 Imma R5- 10.1002/chem.201900771 Et3P(CH2)2F Cd N(CN)2 ambient (21-1)(011)(0-11) C2/c 15 R5- (a,b,-a) 15 C2/c GM4+ (a,-a,0) 12 C2/m GM5+ (a,b,-a) 12 C2/m R5- (a,b,b) 15 C2/c R4- (a,0,a) 74 Imma R5- 10.1039/c8cc07052k Et3P(CH2)2F Cd N(CN)2 373 K (200)(020)(002) Cmce 64 R5- (0,a,0) 140 I4/mcm X5+ (0,0;0,0;a,0) 51 Pmma M2- (a;0;0) 129 P4/nmm M2- (a;0;0) 129 P4/nmm R5- (0,a,0) 140 I4/mcm X5+ (0,0;0,0;a,0) 51 Pmma R5- M2- 10.1039/c8cc07052k Et3PPr Cd N(CN)2 427 K (200)(020)(002) Cmce 64 X5- (0,0;0,0;0,a) 51 Pmma M2- (a;0;0) 129 P4/nmm M2- (a;0;0) 129 P4/nmm X5- (0,0;0,0;0,a) 51 Pmma X5- M2- 10.1021/acs.inorgchem.6b02508 NPr4 Co N(CN)2 368 K (110)(-110)(002) I4/mcm 140 R5- (a,0,0) 140 I4/mcm R5- (a,0,0) 140 I4/mcm R5- 10.1039/C6TC00723F NPr4 Cd N(CN)2 390 K (110)(-110)(002) I4/mcm 140 R5- (a,0,0) 140 I4/mcm R5- (a,0,0) 140 I4/mcm R5- 10.1039/c7tc03136j Et3PPr Cd N(CN)2 397 K (200)(020)(002) Ibam 72 M2+ (a;0;0) 127 P4/mbm M2- (0;a;b) 72 Ibam M2- (0;a;b) 72 Ibam M1+ (a;0;0) 123 P4/mmm M2- 10.1021/acs.inorgchem.6b02508 NPr4 Co N(CN)2 323 K (110)(-110)(002) Ibam 72 R5- (a,0,0) 140 I4/mcm GM5+ (a,0,0) 65 Cmmm R5- (a,0,0) 140 I4/mcm R5- R3-/GM5+ 10.1039/C6TC00723F Bu3NMe Mn N(CN)2 295 K (21-1)(011)(0-22) P2_1/c 13 R5- (0,a,a) 74 Imma GM4+ (a,a,0) 12 C2/m X5+ (0,0;0,0;a,a) 63 Cmcm M2- (a;0;0) 129 P4/nmm GM5+ (a,b,-b) 12 C2/m LD2,LD3 R5- (0,a,a) 74 Imma LD3 (0,0,0,0;0,0,0,0;a, -3.732a, -3.732a,a;b,-0.268b,0.268b,-b) 14 P2_1/c X5+ (0,0;0,0;a,a) 63 Cmcm LD3 10.1039/c9dt02924a Et3P-ene Mn N(CN)2 ambient (110)(-110)(002) P2_1/c 13 R5- (a,b,b) 15 C2/c GM4+ (a,-a,0) 12 C2/m X5+ (0,0;0,0;a,a) 63 Cmcm M2- (a;0;0) 129 P4/nmm GM5+ (a,b,b) 12 C2/m R5- (a,b,b) 15 C2/c M2- (a;0;0) 129 P4/nmm X5+ (0,0;0,0;a,a) 63 Cmcm R5- M2-/X5+ 10.1039/c6tc05105g Et3P(CH2)2Cl Mn N(CN)2 ambient (110)(-110)(002) P2_1/c 13 R5- (a,b,b) 15 C2/c, GM4+ (a,-a,0) 12 C2/m X5+ (0,0;0,0;a,a) 63 Cmcm M2- (a;0;0) 129 P4/nmm GM5+ (a,b,b) 12 C2/m R5- (a,b,b) 15 C2/c M2- (a;0;0) 129 P4/nmm X5+ (0,0;0,0;a,a) 63 Cmcm R5- M2-/X5+ 10.1002/chem.201900771 SPh3 Mn N(CN)2 ambient (110)(-110)(002) P2_1/c 13 R5- (a,b,b) 15 C2/c GM4+ (a,-a,0) 12 C2/m X5+ (0,0;0,0;a,a) 63 Cmcm M2- (a;0;0) 129 P4/nmm GM5+ (a,b,b) 12 C2/m R5- (a,b,b) 15 C2/c X5+ (0,0;0,0;a,a) 63 Cmcm M5- (a,a;0,0;0,0) 51 Pmma R5- M2-/X5+ 10.1021/ic035398p Et3PR-oR Mn N(CN)2 173 K (10-1)(020)(002) P2_1/c 13 R5- (0,a,b) 12 C2/m GM4+ (0,0,a) 83 P4/m X5+ (0,0;0,0;a,b) 11 P2_1/m M2- (a;0;0) 129 P4/nmm GM5+ (a,0,0) 65 Cmmm R5- (0,a,b) 12 C2/m X5+ (0,0;0,0;a,b) 11 P2_1/m M2- (a;0;0) 129 P4/nmm R5- X5+ 10.1039/c6tc05105g Et3PPr Cd N(CN)2 223 K (10-1)(020)(002) P2_1/c 13 R5- (a,b,0) 12 C2/m GM4+ (0,a,0) 83 P4/m X5+ (a,b;0,0;0,0) 11 P2_1/m M2- (0;a;0) 129 P4/nmm GM5+ (0,0,a) 65 Cmmm R5- (a,b,0) 12 C2/m X5+ (a,b;0,0;0,0) 11 P2_1/m M2- (0;a;0) 129 P4/nmm R5- X5+ 10.1021/acs.inorgchem.6b02508 NPr4 Mn N(CN)2 3.3 GPa (200)(020)(-202) P2_1/c 13 R5- (a,b,0) 12 C2/m M2+ (0;a;0) 127 P4/mbm GM4+ (0,a,0) 83 P4/m X5- (a,b;0,0;0,0) 11 P2_1/m X5+ (0,0;0,a;b,0) 59 Pmmn M2- (a;0;b) 72 Ibam GM5+ (0,0,a) 65 Cmmm R5- (a,b,0) 12 C2/m M2- (a;0;b) 72 Ibam M2+ (0;a;0) 127 P4/mbm R5- X5+/M2- 10.1039/c9dt01648a NPr4 Cd N(CN)2 100 K (200)(020)(-202) P2_1/c 13 R5- (a,b,0) 12 C2/m M2+ (0;a;0) 127 P4/mbm GM4+ (0,a,0) 83 P4/m X5- (a,b;0,0;0,0) 11 P2_1/m X5+ (0,0;0,a;b,0) 59 Pmmn M2- (a;0;b) 72 Ibam GM5+ (0,0,a) 65 Cmmm R5- (a,b,0) 12 C2/m M2- (a;0;b) 72 Ibam M1+ (0;a;0) 123 P4/mmm R5- X5+/M2- 10.1039/c7tc03136j Et3PPr Mn N(CN)2 ambient (110)(-110)(002) P2_12_12_1 19 R5- (0,a,a) 74 Imma M2+ (a;0;0) 127 P4/mbm X5- (0,0;0,0;a,a) 63 Cmcm X5+ (0,0;0,0;a,a) 63 Cmcm M2- (a;0;0) 129 P4/nmm GM5+ (a,0,0) 65 Cmmm R5- (0,a,a) 74 Imma M2- (a;0;0) 129 P4/nmm X5- (0,0;0,0;a,a) 63 Cmcm R5- X5- M2- 10.1039/c6tc05105g Et3PR-oR Mn N(CN)2 ambient (110)(-110)(002) P2_12_12_1 19 R5- (0,a,a) 74 Imma M2+ (a;0;0) 127 P4/mbm X5- (0,0;0,0;a,a) 63 Cmcm X5+ (0,0;0,0;a,a) 63 Cmcm M2- (a;0;0) 129 P4/nmm GM5+ (a,0,0) 65 Cmmm R5- (0,a,a) 74 Imma M2- (a;0;0) 129 P4/nmm X5- (0,0;0,0;a,a) 63 Cmcm R5- X5- M2- 10.1039/c6tc05105g Et3PPr Cd N(CN)2 293 K (110)(002)(1-10) P2_12_12_1 19 R5- (0,a,a) 74 Imma M2+ (a;0;0) 127 P4/mbm X5- (0,0;0,0;a,a) 63 Cmcm X5+ (0,0;0,0;a,a) 63 Cmcm M2- (a;0;0) 129 P4/nmm GM5+ (a,0,0) 65 Cmmm R5- (0,a,a) 74 Imma M2- (a;0;0) 129 P4/nmm X5- (0,0;0,0;a,a) 63 Cmcm R5- X5- M2- 10.1021/acs.inorgchem.6b02508 Et3P(CH2)2Cl Cd N(CN)2 ambient (110)(-110)(002) P2_12_12_1 19 R5- (0,a,a) 74 Imma M2+ (a;0;0) 127 P4/mbm X5- (0,0;0,0;a,a) 63 Cmcm X5+ (0,0;0,0;a,a) 63 Cmcm M2- (a;0;0) 129 P4/nmm GM5+ (a,0,0) 65 Cmmm R5- (0,a,a) 74 Imma M2- (a;0;0) 129 P4/nmm X5- (0,0;0,0;a,a) 63 Cmcm R5- X5- M2- 10.1039/c8cc07052k NPr4 Co N(CN)2 200 K (200)(020)(002) P -42_1c 114 R5- (a,0,0) 140 I4/mcm M2+ (0;a;-a) 139 I4/mmm X5- (a,0;0,-a;0,0) 129 P4/nmm X5+ (a,0;0,a;0,0) 127 P4/mbm M2- (a;b;b) 121 I-42m R5- (a,0,0) 140 I4/mcm M2- (a;b;b) 121 I-42m M2+ (0;a;-a) 139 I4/mmm R5- M2- 10.1039/C6TC00723F NPr4 Mn N(CN)2 ambient (200)(020)(002) P -42_1c 114 R5- (a,0,0) 140 I4/mcm M2+ (0;a;-a) 139 I4/mmm X5- (a,0;0,-a;0,0) 129 P4/nmm X5+ (a,0;0,a;0,0) 127 P4/mbm M2- (a;b;b) 121 I-42m R5- (a,0,0) 140 I4/mcm M2- (a;b;b) 121 I-42m M2+ (0;a;-a) 139 I4/mmm R5- M2- 10.1021/ic0484598 NPr4 Mn N(CN)2 ambient (200)(020)(002) P -42_1c 114 R5- (a,0,0) 140 I4/mcm M2+ (0;a;-a) 139 I4/mmm X5- (a,0;0,-a;0,0) 129 P4/nmm X5+ (a,0;0,a;0,0) 127 P4/mbm M2- (a;b;b) 121 I-42m R5- (a,0,0) 140 I4/mcm M2- (a;b;b) 121 I-42m M2+ (0;a;-a) 139 I4/mmm R5- M2- 10.1039/c9dt01648a NPr4 Cd N(CN)2 ambient (200)(020)(002) P -42_1c 114 R5- (a,0,0) 140 I4/mcm M2+ (0;a;-a) 139 I4/mmm X5- (a,0;0,-a;0,0) 129 P4/nmm X5+ (a,0;0,a;0,0) 127 P4/mbm M2- (a;b;b) 121 I-42m R5- (a,0,0) 140 I4/mcm M2- (a;b;b) 121 I-42m M2+ (0;a;-a) 139 I4/mmm R5- M2- 10.1039/c7tc03136j NPr4 Mn N(CN)2 0.5 GPa (200)(020)(002) Pbcn 60 R5- (0,0,a) 140 I4/mcm M2+ (a;0;0) 127 P4/mbm X5- (0,0;0,0;0,a) 51 Pmma X5+ (0,0;a,0;0,0) 51 Pmma M2- (0;a;b) 72 Ibam R5- (0,0,a) 140 I4/mcm M2- (0;a;b) 72 Ibam M2+ (a;0;0) 127 P4/mbm R5- M2- 10.1039/c9dt01648a Et3P(CH2)2Cl Cd N(CN)2 333 K (200)(020)(002) Pbcn 60 R5- (0,0,a) 140 I4/mcm M2+ (a;0;0) 127 P4/mbm X5- (0,0;0,0;0,a) 51 Pmma X5+ (0,0;a,0;0,0) 51 Pmma M2- (0;a;b) 72 Ibam M2- (0;a;b) 72 Ibam R5- (0,0,a) 140 I4/mcm X5- (0,0;0,0;0,a) 51 Pmma R5- M2- 10.1039/c8cc07052k Et3P(CH2)2F Mn N(CN)2 347 K (200)(020)(002) Pbcn 60 R5- (0,0,a) 140 I4/mcm M2+ (a;0;0) 127 P4/mbm X5- (0,0;0,0;0,a) 51 Pmma X5+ (0,0;a,0;0,0) 51 Pmma M2- (0;a;b) 72 Ibam R5- (0,0,a) 140 I4/mcm M2- (0;a;b) 72 Ibam M2+ (a;0;0) 127 P4/mbm R5- M2- 10.1002/chem.201900771 Et3NBn Mn/Fe N(CN)2 ambient (110)(002)(1-10) Pnma 62 R5- (0,a,a) 74 Imma M2+ (a;0;0) 127 P4/mbm X5- (0,0;0,0;a,a) 63 Cmcm GM5+ (a,0,0) 65 Cmmm R5- (0,a,a) 74 Imma M2+ (a;0;0) 127 P4/mbm R5- M2+ 10.1039/b300760j Bu3NBn Mn/Co N(CN)2 ambient (110)(002)(1-10) Pnma 62 R5- (0,a,a) 74 Imma M2+ (a;0;0) 127 P4/mbm X5- (0,0;0,0;a,a) 63 Cmcm GM5+ (a,0,0) 65 Cmmm R5- (0,a,a) 74 Imma M2+ (a;0;0) 127 P4/mbm R5- M2+ 10.1039/b300760j Bu3NMe Mn N(CN)2 375 K (110)(002)(1-10) Pnma 62 R5- (0,a,a) 74 Imma M2+ (a;0;0) 127 P4/mbm X5- (0,0;0,0;a,a) 63 Cmcm GM5+ (a,0,0) 65 Cmmm R5- (0,a,a) 74 Imma M2+ (a;0;0) 127 P4/mbm R5- M2+ 10.1039/c9dt02924a NPr4 Co N(CN)2 300 K (200)(02-2)(022) Pnna 52 R5- (0,a,0) 140 I4/mcm X1- (0;a;0) 124 P4/mcc X5+ (0,a;0,0;-a,0) 127 P4/mbm M2- (a;-a;0) 140 I4/mcm GM5+ (0,a,0) 65 Cmmm S1, S2, SM3, SM4 R5- (0,a,0) 140 I4/mcm S1 (0,0;0,0;0,a;0,0;0,0;0,0) 65 Cmmm SM3 (0,0;0,0;0,0;0,0;0,0;0,a) 51 Pmma SM3 R5- S1 10.1039/C6TC00723F NPr4 Ni N(CN)2 ambient (200)(02-2)(022) Pnna 52 R5- (0,a,0) 140 I4/mcm X1- (0;a;0) 124 P4/mcc X5+ (0,a;0,0;-a,0) 127 P4/mbm M2- (a;-a;0) 140 I4/mcm GM5+ (0,a,0) 65 Cmmm S1, S2, SM3, SM4 R5- (0,a,0) 140 I4/mcm S1 (0,0;0,0;0,a;0,0;0,0;0,0) 65 Cmmm SM3 (0,0;0,0;0,0;0,0;0,0;0,a) 51 Pmma SM3 R5- S1 10.1021/ic0484598 (CH3)3NH Mn N3 330 K (110)(-110)(002) C2/c 15 GM4+ (a,-a,0) 12 C2/m X1- (0;0;a) 124 P4/mcc X5- (0,0;0,0;a,-a) 63 Cmcm GM5+ (a,b,b) 12 C2/m X5- (0,0;0,0;a,-a) 63 Cmcm GM5+ (a,b,b) 12 C2/m X1- (0;0;a) 124 P4/mcc GM5+ X5- 10.1021/ja407654n (CH3)3NH Cd N3 348 K (110)(-110)(002) C2/c 15 GM4+ (a,-a,0) 12 C2/m X1- (0;0;a) 124 P4/mcc X5- (0,0;0,0;a,-a) 63 Cmcm GM5+ (a,b,b) 12 C2/m X5- (0,0;0,0;a,-a) 63 Cmcm GM5+ (a,b,b) 12 C2/m X1- (0;0;a) 124 P4/mcc GM5+ X5- 10.1039/c5cc06863k N(CH3)4 Cd N3 220 K (21-1)(011)(0-11) C2/c 15 R5- (a,b,-a) 15 C2/c GM4+ (0,a,a) 12 C2/m GM5+ (a,b,-a) 12 C2/m GM4+ (0,a,a) 12 C2/m R5- (a,b,a) 15 C2/c R5- 10.1039/c3cc48581a Et2(CH3)NH Mn N3 ambient (110)(-110)(002) Cc 9 GM4+ (a,-a,0) 12 C2/m X1- (0;0;a) 124 P4/mcc X5- (0,0;0,0;a,-a) 63 Cmcm X5+ (0,0;0,0;a,a) 63 Cmcm GM5+ (a,b,b) 12 C2/m X5+ (0,0;0,0;a,a) 63 Cmcm GM5+ (a,b,b) 12 C2/m X5+ GM4- 10.1515/znb-2018-0183 (CH3)2NH2 Mn N3 323 K (200)(020)(002) Cmce 64 R5- (0,a,0) 140 I4/mcm X5+ (0,0;0,0;a,0) 51 Pmma M2- (a;0;0) 129 P4/nmm X5+ (0,0;0,0;a,0) 51 Pmma M2- (a;0;0) 129 P4/nmm R5- (0,a,0) 140 I4/mcm X5+ M2- 10.1021/ja407654n (CH3)2NH2 Mn N3 173 K (100)(011)(0-11) P2_1 4 M2+ (0;0;a) 127 P4/mbm GM4+ (0,a,a) 12 C2/m M5+ (0,0;0,0;a,-a) 53 Pmna M2- (0;0;a) 129 P4/nmm GM5+ (a,b,-a) 12 C2/m M2- (0;0;a) 129 P4/nmm M5+ (0,0;0,0;a,-a) 53 Pmna M2+ (0;0;a) 127 P4/mbm M2+ M5+ M2- 10.1021/ja407654n (CH3)3NH Mn N3 173 K (110)(-110)(002) P2_1/c 13 GM4+ (a,-a,0) 12 C2/m X1- (0;0;a) 124 P4/mcc X5- (0,0;0,0;a,-a) 63 Cmcm M2- (a;0;0) 129 P4/nmm GM5+ (a,b,b) 12 C2/m X5- (0,0;0,0;a,-a) 63 Cmcm GM5+ (a,b,b) 12 C2/m X1- (0;0;a) 124 P4/mcc GM5+ X5- M2- 10.1021/ja407654n (CH3)3NH Cd N3 283 K (110)(-110)(002) P2_1/c 13 GM4+ (a,-a,0) 12 C2/m X1- (0;0;a) 124 P4/mcc X5- (0,0;0,0;a,-a) 63 Cmcm M2- (a;0;0) 129 P4/nmm GM5+ (a,b,b) 12 C2/m X5- (0,0;0,0;a,-a) 63 Cmcm GM5+ (a,b,b) 12 C2/m X1- (0;0;a) 124 P4/mcc GM5+ X5- M2- 10.1039/c5cc06863k CH3NH3 Mn N3 320 K (110)(-110)(002) P2_1/c 13 R5- (a,b,b) 15 C2/c GM4+ (a,-a,0) 12 C2/m X5+ (0,0;0,0;a,a) 63 Cmcm M2- (a;0;0) 129 P4/nmm GM5+ (a,b,b) 12 C2/m M2- (a;0;0) 129 P4/nmm R5- (a,b,b) 15 C2/c M5- (a,a;0,0;0,0) 51 Pmma R5- M2-/X5+ 10.1021/ja407654n CH3NH3 Mn N3 173 K (100)(01-1)(022) P2_1/c 13 GM4+ (0,a,-a) 12 C2/m M2- (0;0;a) 129 P4/nmm GM5+ (a,b,a) 12 C2/m SM2, SM4 M2- (0;0;a) 129 P4/nmm SM2 (0,0;0,0;0,0;0,0;a,-a;0,0) 55 Pbam SM4 (0,0;0,0;0,0;0,0;a,a;0,0) 54 Pcca SM2 M2- 10.1021/ja407654n N(CH3)4 Mn N3 173 K (100)(020)(001) P2_1/m 11 GM4+ (0,a,0) 83 P4/m X5- (a,b;0,0;0,0) 11 P2_1/m GM5+ (0,0,a) 65 Cmmm X5- (a,b;0,0;0,0) 11 P2_1/m GM4+ (0,a,0) 83 P4/m X5- 10.1021/ja407654n N(CH3)4 Cd N3 ambient (100)(020)(001) P2_1/m 11 GM4+ (0,a,0) 83 P4/m X5- (a,b;0,0;0,0) 11 P2_1/m GM5+ (0,0,a) 65 Cmmm X5- (a,b;0,0;0,0) 11 P2_1/m GM4+ (0,a,0) 83 P4/m X5- 10.1039/c3cc48581a N(CH3)4 Ca N3 ambient (110)(-110)(001) P4/nmm 129 M2- (a;0;0) 129 P4/nmm M2- (a;0;0) 129 P4/nmm M2- 10.1007/BF00808305 (CH3)2NH2 Cd N3 150 K (100)(010)(001) P -1 2 GM4+ (a,b,c) 2 P -1 GM5+ (a,b,c) 2 P -1 GM4+ (a,b,c) 2 P -1 GM4+ 10.1002/anie.201408491 cPrNH3 Mn N3 ambient (110)(002)(2-20) Pbca 61 R5- (a,0,0) 140 I4/mcm X5+ (0,0;0,0;a,-a) 63 Cmcm GM5+ (a,0,0) 65 Cmmm SM3, S2 SM3 (0,0;a,a;0,0;0,0;0,0;0,0) 57 Pbcm R5- (a,0,0) 140 I4/mcm M5- (a,-a;0,0;0,0) 51 Pmma SM3 R5- 10.1515/znb-2016-0267 N(CH3)4 Mn N3 333 K (100)(010)(001) Pm -3m 221 10.1021/ja407654n N(CH3)4 Cd N3 350 K (100)(010)(001) Pm -3m 221 10.1039/c3cc48581a (CH3)2NH2 Cd N3 273 K (101)(-110)(-1-11) R -3 148 GM4+ (a,a,-a) 148 R -3 GM5+ (a,-a,-a) 166 R -3m GM4+ (a,a,-a) 148 R -3 GM4+ 10.1002/anie.201408491 (CH3)3NH Mn N3 360 K (101)(-110)(-1-11) R -3m 166 GM5+ (a,-a,-a) 166 R -3m GM5+ (a,-a,-a) 166 R -3m GM5+ 10.1021/ja407654n