Chalc1 | atoms | C14 | C2 | C13 | C8 | C9 | C7 | N3 | C5 |
| +0.077 | +0.031 | −0.007 | −0.014 | −0.043 | −0.056 | −0.080 | −0.195 | |
| +0.131 | +0.039 | +0.040 | +0.066 | +0.007 | +0.014 | +0.024 | −0.039 | |
| +0.054 | +0.008 | +0.047 | +0.080 | +0.050 | +0.070 | +0.104 | +0.156 | |
Rk | +0.428 | +0.153 | ±0.165 | ±0.276 | −0.124 | −0.156 | −0.218 | −0.667 | |
Chalc2 | atoms | C14 | C2 | C13 | C8 | C9 | C7 | N3 | C5 |
| +0.083 | +0.032 | −0.007 | −0.013 | −0.044 | −0.055 | −0.079 | −0.192 | |
| +0.133 | +0.039 | +0.041 | +0.066 | +0.005 | +0.014 | +0.024 | −0.039 | |
| +0.050 | +0.008 | +0.048 | +0.079 | +0.049 | +0.069 | +0.102 | +0.153 | |
Rk | +0.469 | +0.158 | ±0.170 | ±0.277 | −0.126 | −0.147 | −0.205 | −0.655 | |
Chalc3 | atoms | C14 | C2 | C8 | C7 | C9 | C13 | N3 | C5 |
| +0.157 | +0.027 | +0.017 | −0.048 | −0.014 | −0.091 | −0.028 | −0.100 | |
| +0.141 | +0.039 | +0.067 | +0.014 | +0.008 | +0.019 | +0.024 | −0.036 | |
| −0.016 | +0.016 | +0.049 | +0.032 | +0.023 | +0.110 | +0.052 | +0.062 | |
Rk | +0.597 | +0.086 | ±0.222 | −0.071 | −0.570 | ±0.249 | −0.112 | −0.377 | |
Chalc4 | atoms | C14 | C2 | C13 | C8 | C9 | C7 | N3 | C5 |
| +0.049 | +0.029 | +0.028 | −0.021 | −0.043 | −0.058 | −0.084 | −0.201 | |
| +0.108 | +0.035 | +0.056 | +0.059 | +0.008 | +0.013 | +0.023 | −0.039 | |
| +0.058 | +0.006 | +0.028 | +0.080 | +0.016 | +0.072 | +0.108 | +0.163 | |
Rk | +0.384 | +0.163 | +0.205 | ±0.273 | −0.113 | −0.150 | −0.204 | −0.693 | |
Chalc5 | atoms | C14 | C2 | C13 | C8 | C9 | C7 | N3 | C5 |
| +0.053 | +0.030 | +0.022 | −0.021 | −0.045 | −0.060 | −0.087 | −0.201 | |
| +0.115 | +0.037 | +0.049 | +0.063 | +0.007 | +0.014 | +0.022 | −0.039 | |
| +0.062 | +0.007 | +0.028 | +0.083 | +0.052 | +0.074 | +0.109 | +0.167 | |
Rk | +0.336 | +0.147 | +0.138 | ±0.271 | −0.129 | −0.163 | −0.233 | −0.690 |