system na1 no ns SG V1 dV1 dSh dTv da db dc dalp dbet dgam dr phi dev str # # # str Ao3 % % % % % % deg deg deg mAo deg mAo median 0.5 4.3 4.5 0.3 -0.3 -0.1 0.0 -0.1 0.0 8444166.1 4708 mean 0.5 6.0 6.2 0.1 0.4 0.1 -0.1 -1.2 -0.1 8241150.6 4832 standard dev 4.5 5.6 5.5 4.7 5.8 5.4 0.8 8.8 1.1 3548 42.2 1979 lower decile -4.4 2.1 2.4 -5.0 -5.7 -5.9 -0.9 -4.1 -0.6 3221107.0 2724 upper decile 6.0 11.7 11.9 5.9 7.6 6.3 0.2 3.2 0.112913177.5 7184 min -12.6 0.0 1.4 -14.3 -10.9 -14.8 -3.4 -60.7 -3.5 590 1.5 141 max 18.8 40.4 40.1 9.2 16.7 13.3 2.6 25.7 4.117935179.910047 ------------------------------------------------------------------------------------------------------------------ anthracene 24 1 2 P21/c 9.38 -4.0 3.0 3.6 -4.2 -0.1 -0.5 0.0 -2.5 -0.0 6289174.4 3189 anthraquinone 24 1 2 P21/c 9.67 1.8 1.3 1.9 2.3 -1.7 1.0 -0.1 -0.5 0.0 8040158.9 5159 benzene 12 1 2 Pbca 9.54 -5.9 0.8 2.3 -3.0 -2.1 -0.9 -0.0 -0.0 0.0 6487173.4 4192 benzeneF6 12 2 1 P21/n 13.26 -2.0 6.8 6.8 8.8 -10.9 1.1 0.0 0.3 -0.0 6701124.0 4934 benzeneO2 12 1 2 P21/c 10.70 -2.2 5.7 5.7 -5.7 -3.0 6.1 -0.0 -3.4 0.0 5668160.1 2718 benzodithiopheneO2 18 1 2 P21/n 11.82 6.7 8.7 10.7 -3.1 -0.4 9.7 0.0 -4.9 0.0 8611177.2 5087 benzotrithiophene 21 1 1 P21/n 12.45 0.9 4.4 4.5 -3.2 -1.7 6.3 0.0 0.3 -0.0 4243156.6 5303 benzotrithiopheneA 21 2 1 P21 12.11 7.6 12.5 11.2 2.3 16.7 -10.2 0.3 -1.4 -3.111977155.1 4760 bithiophene 16 1 2 P21/c 11.72 -3.9 11.7 12.0 4.6 6.2 -14.8 -1.9 -3.8 -2.5 6152175.9 3253 BODIPY 21 1 1 C2/c 9.97 1.1 2.6 2.8 -1.3 -0.9 3.3 -0.0 0.0 -0.012917176.5 5766 BTBT 24 1 2 P21/c 10.91 2.3 4.0 4.0 -2.3 -1.3 6.1 0.0 -0.1 0.0 7194166.1 4251 C60 60 1 6 Pa-3 11.70 18.8 0.0 5.9 5.9 5.9 5.9 0.0 0.0 0.013152175.4 9592 carbazole 22 1 2 Pnma 9.21 -2.8 3.9 4.5 0.3 -2.7 0.2 0.0 -6.5 0.0 3200130.6 1316 carbazoleNO2b 24 1 1 P21/n 9.96 -2.6 5.9 6.7 -3.1 7.1 -5.6 0.0 1.8 0.012803157.1 5101 chrysene 30 1 2 C12/n1 9.38 -0.2 1.5 1.4 0.6 0.8 -1.8 -0.2 -1.0 0.211851172.3 7939 coronene 36 1 2 P21/n 9.57 -1.2 3.3 2.9 1.9 -5.0 2.0 -1.2 -0.2 -0.1 8553173.0 5736 DATT 48 1 1 P21 9.98 4.1 5.6 4.7 7.9 -0.7 -2.2 -0.0 4.0 -0.111293174.3 5754 DBTTF 26 1 2 P21/c 11.69 0.1 7.6 7.6 4.8 -5.3 4.4 0.1 4.2 0.1 7557165.6 3454 dibenzoindigo 42 1 2 P21/n 9.59 0.0 3.6 3.6 -0.9 1.9 -1.0 -0.0 -4.0 -0.013830169.4 8104 DNBDT 42 1 2 P21/n 9.94 -1.2 3.2 2.8 0.6 -4.1 2.0 -0.0 -1.2 -0.0 9958136.4 5883 DNTT 36 1 1 P21 10.39 -1.1 2.1 2.4 0.5 0.2 -1.9 0.0 -2.2 0.0 8800172.1 4508 hexacene 42 2 2 P-1 9.05 5.5 4.7 3.7 5.3 2.4 -2.5 -1.5 -0.8 0.6 3513 93.6 2144 HMTTF 28 1 1 P21/c 10.18 3.7 3.9 3.5 6.2 -3.3 1.2 -0.0 1.2 0.0 4198149.0 4545 ICZb 32 1 2 P21/c 9.16 -4.4 4.1 4.3 -0.1 3.3 -7.4 0.1 -0.3 -0.0 7748179.2 3933 ICZbCl2c 32 1 2 P21/c 10.34 -1.6 4.3 4.4 -0.5 3.2 -5.2 -0.2 -4.1 0.1 8056175.6 4327 IF12b 34 1 2 P21/n 9.17 6.7 9.4 8.5 -2.8 15.7 -5.2 0.0 -3.5 0.0 8362167.9 4353 IF21a 34 1 1 P21/c 9.58 6.2 6.8 5.2 -3.8 12.5 -1.7 -2.5 1.1 3.4 1065 5.6 144 indigo 30 1 2 P21/n 9.59 0.9 2.5 2.6 -0.6 1.6 1.6 0.0 2.5 0.0 6665177.5 4060 indigoCl2 30 1 2 P21/c 11.01 -0.6 3.8 3.9 -0.2 1.5 -3.5 0.5 -2.8 -0.0 2286 47.2 1356 naphthalene 18 1 2 P21/c 9.41 -3.1 6.7 6.8 3.2 4.7 -8.6 -0.0 2.3 0.0 5005166.4 2890 NDFPh 44 1 2 P21/c 9.86 2.8 3.7 3.4 -1.6 6.2 -1.5 0.0 0.6 0.010399163.1 5825 NDI 26 2 2 P-1 10.07 1.2 9.6 9.6 9.2 -3.9 -5.9 -3.4 7.9 -3.3 7100162.0 3461 NDT 24 2 2 P21/c 10.92 2.8 2.8 3.5 3.1 0.5 -0.9 -0.0 -2.1 0.1 8522136.4 4705 oligothiophene4 30 1 2 P21/a 11.73 -1.7 9.5 9.4 -13.4 8.3 4.3 -0.2 -1.9 -0.6 8112172.7 4581 oligothiophene6 44 1 2 P21/a 11.70 -0.5 10.9 10.8 -14.3 9.4 6.2 -0.0 0.1 0.011506169.7 6738 OPV3CN 42 1 2 Pbca 10.12 -1.7 8.4 9.2 4.3 -0.4 -5.4 0.5 -0.0 0.017935174.610047 PBBTZ 30 1 1 P21/n 10.57 0.5 4.3 4.5 -5.1 3.2 2.3 -0.0 -1.4 -0.0 8579141.7 7204 PDI 40 1 2 P21/n 9.64 3.0 3.1 3.0 4.9 1.4 -3.0 0.0 1.9 0.1 9076171.3 5953 pentacene 36 2 2 P-1 9.17 3.8 5.4 4.7 6.1 0.6 -3.6 2.6 -0.7 -0.5 8612168.7 4006 pentaceneN2Cl4 34 1 2 P21/n 11.88 0.8 3.7 3.9 -5.0 3.4 2.2 -0.0 -3.6 -0.010464156.0 6614 pentaceneN4O2 32 1 2 P21/n 9.92 1.9 0.6 1.5 -0.0 0.8 1.1 -0.0 0.4 0.010268149.5 5811 perylene 32 1 2 P21/c 9.16 1.1 10.8 11.0 -0.4 -9.5 13.3 0.4 2.5 4.1 8562173.2 4443 phenazine 22 1 2 P21/n 9.75 -2.0 2.0 2.2 0.5 -2.0 -1.3 0.0 -2.1 0.0 6917176.1 4010 PTCDA 38 1 2 P21/c 10.10 4.1 6.2 7.5 2.4 5.8 -2.6 0.1 4.9 -0.111772155.3 6689 pyrene 26 1 1 P21/a 9.60 -4.1 2.2 2.6 -3.1 1.0 -1.7 0.1 1.6 -0.0 9041178.3 4708 quinacridone 36 1 2 P21/c 9.47 1.5 12.3 12.0 -10.9 15.2 -2.2 -0.0 -5.3 -0.0 8612148.5 5049 spirobidibenzosilole 41 1 2 P41212 10.43 1.4 2.6 3.0 -0.6 -0.6 2.6 -0.2 0.2 -0.313880148.5 9217 spirobifluorene 41 1 1 P21/c 10.11 -0.4 3.5 3.5 -5.3 2.8 2.2 0.0 -0.4 -0.0 1744109.3 4075 stilbene 26 2 2 P21/a 9.37 -4.5 2.4 3.0 -4.2 -0.5 -0.1 0.0 -0.4 0.0 7056150.1 3307 TCNQ 20 1 2 C2/c 12.42 1.0 7.2 7.1 0.4 7.7 -6.3 0.2 0.2 -3.5 9103166.3 5273 TCNQ-F2 20 1 4 C2/m 12.84 4.1 2.9 3.3 2.7 4.2 -2.0 -0.0 1.5 0.0 8128151.5 4001 TCNQ-F4 20 1 2 Pbca 13.90 3.4 5.1 4.9 7.7 -0.7 -3.3 -0.0 1.0 -0.010104170.2 5549 tetracene 30 2 2 P-1 9.30 -0.3 17.9 17.9 1.7 -5.6 1.6 -2.1 25.7 -0.3 8444162.6 3603 thiazolothiazolePh 30 1 2 P21/c 10.70 -5.8 15.0 13.4 -2.2 -8.5 3.9 0.0 -18.2 -0.113114178.2 6896 TPP 34 1 1 P21/c 10.07 -7.2 2.5 3.5 -3.2 -3.1 -0.7 0.3 3.2 -1.5 5853175.5 4515 triazine 9 1 2 C2/c 10.20 -12.6 40.4 40.1 -4.9 -5.2 -12.7 -0.0 -60.7 -0.1 6933179.9 2803 triphenylbenzene 42 1 1 Pna21 9.55 -1.3 5.4 5.7 2.4 -5.7 2.2 0.0 -0.0 -0.2 590 9.3 1381 triphenylene 30 1 1 P212121 9.25 0.2 2.3 2.3 -3.4 2.6 1.1 0.0 0.0 0.014255179.8 6237 triphenyltriazine 39 1 1 P21/c 9.43 -0.8 3.3 3.2 3.8 -4.0 -0.4 0.0 -2.4 0.1 1132 1.5 141 triptycene 34 1 1 P212121 9.77 -0.4 4.3 4.4 1.2 2.5 -4.0 0.0 -0.0 0.1 3932106.8 3350 TTAa 36 1 2 P21/n 11.27 5.2 5.6 6.6 -0.9 -0.3 6.5 -0.1 -3.3 0.010341163.0 5409 TTAb 36 1 2 P21/n 11.25 0.6 12.6 12.7 2.1 -10.9 13.1 -0.0 6.4 0.0 9223162.8 5557 TTF 14 1 2 P21/c 13.51 -7.3 5.6 4.0 -2.0 -5.9 1.7 0.0 3.1 -0.0 7258139.4 4221 TTPa 34 1 2 P21/n 11.67 6.0 11.1 12.8 4.0 -9.2 12.5 0.1 -5.1 -0.010729170.5 5731 TTPb 34 2 2 P21/a 11.83 0.9 2.8 3.1 2.9 -3.0 1.4 0.2 0.6 0.012865171.8 8819 TTPc 34 1 1 P21 11.92 1.9 5.3 5.7 5.1 -5.2 1.8 -0.0 -3.5 -0.0 1438 27.9 4935 TTTT 18 1 2 P21/n 12.70 8.8 5.4 7.2 1.8 -2.0 7.9 -1.0 -3.3 -1.6 8365178.7 5123