# Details of computing
0: GLYALA.cif
1: GLYALB.cif
2: GLYALB01.cif
3: GLYALB02.cif
4: GLYALB03.cif
5: GLYALB04.cif
6: GLYALB05.cif
7: GLYALB06.cif
8: GLYALB07.cif
9: GLYALB08.cif
10: GLYALB09.cif
11: GLYALB10.cif
12: GLYALB11.cif
13: GLYALB12.cif
14: GLYALB13.cif
15: GLYDLA.cif
16: KUTCOS.cif
-------------------------------------
| | 0 | 1 | 2 | 3 | 4 | 5 | 6 | 7 | 8 | 9 | 10 | 11 | 12 | 13 | 14 | 15 | 16 |
| 0 | 0.0000 |
30.2141 |
30.3220 |
30.3123 |
30.2709 |
30.1841 |
30.3179 |
30.3169 |
30.2896 |
30.2745 |
30.2396 |
30.2048 |
30.2868 |
30.3162 |
30.3139 |
31.4067 |
16.3614 |
| 1 | 30.2141 |
0.0000 |
0.0656 |
0.0692 |
0.0377 |
0.0169 |
0.0645 |
0.0608 |
0.0496 |
0.0371 |
0.0212 |
0.0111 |
0.0491 |
0.0640 |
0.0602 |
30.9998 |
13.8605 |
| 2 | 30.3220 |
0.0656 |
0.0000 |
0.0136 |
0.0303 |
0.0714 |
0.0055 |
0.0071 |
0.0172 |
0.0292 |
0.0460 |
0.0653 |
0.0180 |
0.0062 |
0.0082 |
31.0450 |
13.8282 |
| 3 | 30.3123 |
0.0692 |
0.0136 |
0.0000 |
0.0328 |
0.0741 |
0.0106 |
0.0128 |
0.0222 |
0.0336 |
0.0498 |
0.0692 |
0.0229 |
0.0108 |
0.0134 |
31.0565 |
13.8344 |
| 4 | 30.2709 |
0.0377 |
0.0303 |
0.0328 |
0.0000 |
0.0411 |
0.0282 |
0.0247 |
0.0135 |
0.0050 |
0.0173 |
0.0368 |
0.0129 |
0.0276 |
0.0238 |
31.0226 |
13.8480 |
| 5 | 30.1841 |
0.0169 |
0.0714 |
0.0741 |
0.0411 |
0.0000 |
0.0694 |
0.0659 |
0.0541 |
0.0415 |
0.0251 |
0.0116 |
0.0533 |
0.0688 |
0.0650 |
30.9680 |
13.8688 |
| 6 | 30.3179 |
0.0645 |
0.0055 |
0.0106 |
0.0282 |
0.0694 |
0.0000 |
0.0039 |
0.0152 |
0.0276 |
0.0445 |
0.0640 |
0.0159 |
0.0010 |
0.0047 |
31.0453 |
13.8329 |
| 7 | 30.3169 |
0.0608 |
0.0071 |
0.0128 |
0.0247 |
0.0659 |
0.0039 |
0.0000 |
0.0116 |
0.0240 |
0.0409 |
0.0605 |
0.0124 |
0.0036 |
0.0014 |
31.0483 |
13.8338 |
| 8 | 30.2896 |
0.0496 |
0.0172 |
0.0222 |
0.0135 |
0.0541 |
0.0152 |
0.0116 |
0.0000 |
0.0125 |
0.0293 |
0.0489 |
0.0010 |
0.0146 |
0.0108 |
31.0302 |
13.8372 |
| 9 | 30.2745 |
0.0371 |
0.0292 |
0.0336 |
0.0050 |
0.0415 |
0.0276 |
0.0240 |
0.0125 |
0.0000 |
0.0167 |
0.0363 |
0.0119 |
0.0271 |
0.0232 |
31.0230 |
13.8448 |
| 10 | 30.2396 |
0.0212 |
0.0460 |
0.0498 |
0.0173 |
0.0251 |
0.0445 |
0.0409 |
0.0293 |
0.0167 |
0.0000 |
0.0195 |
0.0287 |
0.0439 |
0.0401 |
30.9977 |
13.8538 |
| 11 | 30.2048 |
0.0111 |
0.0653 |
0.0692 |
0.0368 |
0.0116 |
0.0640 |
0.0605 |
0.0489 |
0.0363 |
0.0195 |
0.0000 |
0.0483 |
0.0634 |
0.0597 |
30.9700 |
13.8662 |
| 12 | 30.2868 |
0.0491 |
0.0180 |
0.0229 |
0.0129 |
0.0533 |
0.0159 |
0.0124 |
0.0010 |
0.0119 |
0.0287 |
0.0483 |
0.0000 |
0.0154 |
0.0115 |
31.0291 |
13.8369 |
| 13 | 30.3162 |
0.0640 |
0.0062 |
0.0108 |
0.0276 |
0.0688 |
0.0010 |
0.0036 |
0.0146 |
0.0271 |
0.0439 |
0.0634 |
0.0154 |
0.0000 |
0.0042 |
31.0450 |
13.8326 |
| 14 | 30.3139 |
0.0602 |
0.0082 |
0.0134 |
0.0238 |
0.0650 |
0.0047 |
0.0014 |
0.0108 |
0.0232 |
0.0401 |
0.0597 |
0.0115 |
0.0042 |
0.0000 |
31.0473 |
13.8335 |
| 15 | 31.4067 |
30.9998 |
31.0450 |
31.0565 |
31.0226 |
30.9680 |
31.0453 |
31.0483 |
31.0302 |
31.0230 |
30.9977 |
30.9700 |
31.0291 |
31.0450 |
31.0473 |
0.0000 |
16.8318 |
| 16 | 16.3614 |
13.8605 |
13.8282 |
13.8344 |
13.8480 |
13.8688 |
13.8329 |
13.8338 |
13.8372 |
13.8448 |
13.8538 |
13.8662 |
13.8369 |
13.8326 |
13.8335 |
16.8318 |
0.0000 |