0 mol 26 unq 0 iso 0 dist 9.15677 15.2626 9.61029 15.7188 6.73162 7.95969 numMergedOcc 0
1 mol 26 unq 0 iso 1 dist 9.61029 15.2626 9.15677 7.95969 6.73162 15.7188 numMergedOcc 0
2 mol 52 unq 0 iso 0 dist 7.68916 6.17242 7.47417 10.6328 7.18176 10.4155 numMergedOcc 0
3 mol 52 unq 0 iso 1 dist 7.47417 6.17242 7.68916 10.4155 7.18176 10.6328 numMergedOcc 0
4 mol 59 unq 0 iso 0 dist 7.67586 10.8184 8.97292 10.9894 6.71911 9.55542 numMergedOcc 0
5 mol 59 unq 0 iso 1 dist 8.97292 10.8184 7.67586 9.55542 6.71911 10.9894 numMergedOcc 0
6 mol 86 unq 0 iso 0 dist 7.26032 7.5835 5.49793 11.9674 7.79359 4.51657 numMergedOcc 0
7 mol 86 unq 0 iso 1 dist 5.49793 7.5835 7.26032 4.51657 7.79359 11.9674 numMergedOcc 0
8 mol 100 unq 0 iso 0 dist 5.09688 5.35519 9.26343 10.6273 8.72704 11.6898 numMergedOcc 0
9 mol 100 unq 0 iso 1 dist 9.26343 5.35519 5.09688 11.6898 8.72704 10.6273 numMergedOcc 0
10 mol 176 unq 0 iso 0 dist 4.96326 10.6794 9.09976 12.8521 8.61331 10.9728 numMergedOcc 0
11 mol 176 unq 0 iso 1 dist 9.09976 10.6794 4.96326 10.9728 8.61331 12.8521 numMergedOcc 0
12 mol 176 unq 1 iso 0 dist 4.96326 11.8589 9.73567 12.8521 8.61331 7.46138 numMergedOcc 0
13 mol 176 unq 1 iso 1 dist 9.73567 11.8589 4.96326 7.46138 8.61331 12.8521 numMergedOcc 0
14 mol 176 unq 1 iso 0 dist 9.09976 6.36709 9.73567 10.9728 8.61331 7.46138 numMergedOcc 0
15 mol 176 unq 1 iso 1 dist 9.73567 6.36709 9.09976 7.46138 8.61331 10.9728 numMergedOcc 0
16 mol 182 unq 0 iso 0 dist 6.31492 10.8595 7.8621 5.37421 6.73313 13.0784 numMergedOcc 0
17 mol 182 unq 0 iso 1 dist 7.8621 10.8595 6.31492 13.0784 6.73313 5.37421 numMergedOcc 0
18 mol 238 unq 0 iso 0 dist 7.2527 7.89598 9.29203 14.0776 9.90142 11.091 numMergedOcc 0
19 mol 238 unq 0 iso 1 dist 9.29203 7.89598 7.2527 11.091 9.90142 14.0776 numMergedOcc 0
20 mol 238 unq 1 iso 0 dist 7.13194 7.89598 7.80166 14.751 9.29858 12.4266 numMergedOcc 0
21 mol 238 unq 1 iso 1 dist 7.80166 7.89598 7.13194 12.4266 9.29858 14.751 numMergedOcc 0
22 mol 253 unq 0 iso 0 dist 5.76077 11.7205 7.0247 10.6548 7.19465 3.494 numMergedOcc 0
23 mol 253 unq 0 iso 1 dist 7.0247 11.7205 5.76077 3.494 7.19465 10.6548 numMergedOcc 0
24 mol 282 unq 0 iso 0 dist 8.74201 5.17526 6.65024 8.88596 9.58517 6.25775 numMergedOcc 0
25 mol 282 unq 0 iso 1 dist 6.65024 5.17526 8.74201 6.25775 9.58517 8.88596 numMergedOcc 0
