0 mol 25 unq 0 iso 0 dist 8.46842 13.3513 7.57578 5.85389 6.90155 9.36158 5.03904 4.79873 10.2864 6.86525 numMergedOcc 0
1 mol 25 unq 1 iso 0 dist 8.46842 13.3513 7.57578 5.85389 6.90155 9.36158 16.8735 9.48085 5.18617 13.7717 numMergedOcc 0
2 mol 25 unq 2 iso 0 dist 8.46842 14.4516 7.17969 5.85389 6.90155 10.1525 5.03904 4.79873 11.4148 6.86525 numMergedOcc 0
3 mol 25 unq 3 iso 0 dist 8.46842 14.4516 7.17969 5.85389 6.90155 10.1525 16.8735 9.48085 5.68041 13.7717 numMergedOcc 0
4 mol 45 unq 0 iso 0 dist 6.96797 5.84852 7.2846 11.1814 9.44459 5.73693 4.4519 9.33906 6.42339 10.7651 numMergedOcc 0
5 mol 45 unq 1 iso 0 dist 6.96797 6.5822 7.58835 11.1814 9.44459 11.6164 4.4519 9.33906 5.1274 10.7651 numMergedOcc 0
6 mol 59 unq 0 iso 0 dist 6.47132 9.86595 7.17396 3.97129 8.64015 11.0904 6.13703 6.56212 7.31539 4.88345 numMergedOcc 0
7 mol 59 unq 1 iso 0 dist 6.47132 10.2137 9.21998 3.97129 8.64015 12.9211 6.13703 6.56212 11.1607 4.88345 numMergedOcc 0
8 mol 112 unq 0 iso 0 dist 9.13413 9.79513 7.71338 5.56098 6.47042 10.0814 11.7536 8.47988 6.95317 8.90959 numMergedOcc 0
9 mol 112 unq 1 iso 0 dist 9.13413 9.79513 7.71338 5.56098 6.47042 10.0814 5.8662 8.0427 7.57713 4.4941 numMergedOcc 0
10 mol 131 unq 0 iso 0 dist 7.49404 7.91807 8.40312 10.7835 8.86329 5.89022 7.08715 9.27976 3.98662 5.30999 numMergedOcc 0
11 mol 186 unq 0 iso 0 dist 5.47189 5.48717 7.54065 9.40342 7.20574 8.90184 6.7954 6.61112 11.0961 8.58039 numMergedOcc 0
12 mol 204 unq 0 iso 0 dist 9.65951 11.5989 7.10633 13.1567 6.85441 8.17229 4.51957 7.9133 10.7169 9.54203 numMergedOcc 0
13 mol 204 unq 1 iso 0 dist 9.65951 9.99471 8.51516 13.1567 6.85441 5.74707 4.51957 7.9133 5.57347 9.54203 numMergedOcc 0
14 mol 204 unq 2 iso 0 dist 9.14829 6.73339 7.10633 13.1156 6.85441 8.17229 9.9552 7.9133 10.7169 9.54203 numMergedOcc 0
15 mol 204 unq 3 iso 0 dist 9.14829 13.2127 8.51516 13.1156 6.85441 5.74707 9.9552 7.9133 5.57347 9.54203 numMergedOcc 0
16 mol 214 unq 0 iso 0 dist 9.33638 15.9383 9.65138 13.6007 6.38157 7.38025 10.2403 7.46481 11.4955 5.73082 numMergedOcc 0
17 mol 214 unq 1 iso 0 dist 9.33638 7.31241 7.14453 13.6007 6.38157 9.35273 10.2403 7.46481 8.459 5.73082 numMergedOcc 0
18 mol 214 unq 2 iso 0 dist 9.33638 17.0758 8.85478 13.6007 6.38157 5.63388 10.2403 7.46481 11.1534 5.73082 numMergedOcc 0
19 mol 229 unq 0 iso 0 dist 9.68636 10.705 8.22528 7.82856 8.92743 11.6847 9.76444 7.27993 5.70473 6.93188 numMergedOcc 0
20 mol 229 unq 1 iso 0 dist 9.68636 5.6419 7.03423 7.82856 8.92743 9.62106 9.76444 7.27993 7.22525 6.93188 numMergedOcc 0
21 mol 232 unq 0 iso 0 dist 6.94983 5.08111 8.27212 10.971 7.83711 8.25884 7.30782 6.71524 5.10213 8.03712 numMergedOcc 0
22 mol 234 unq 0 iso 0 dist 7.17987 14.7629 9.45496 14.2602 7.5366 5.63086 12.4759 7.81215 12.4252 11.0592 numMergedOcc 0
23 mol 234 unq 1 iso 0 dist 7.17987 13.5847 6.7625 14.2602 7.5366 5.6819 12.4759 7.81215 5.75498 11.0592 numMergedOcc 0
24 mol 238 unq 0 iso 0 dist 9.09166 6.74773 6.22714 12.8393 5.64181 10.216 17.7087 9.08509 12.7938 6.94907 numMergedOcc 0
25 mol 238 unq 1 iso 0 dist 9.09166 9.48707 7.31233 12.8393 5.64181 7.83352 17.7087 9.08509 11.0772 6.94907 numMergedOcc 0
26 mol 259 unq 0 iso 0 dist 9.89728 5.07898 7.46176 9.80192 8.55558 5.60748 13.7396 5.85442 10.067 7.32929 numMergedOcc 0
27 mol 259 unq 1 iso 0 dist 9.89728 5.07898 7.46176 9.80192 8.55558 5.60748 15.7491 6.95511 11.6988 9.55426 numMergedOcc 0
28 mol 264 unq 0 iso 0 dist 6.20796 6.9758 9.17653 7.79077 6.14323 13.0621 4.66338 8.29262 10.7813 5.82131 numMergedOcc 0
29 mol 264 unq 1 iso 0 dist 7.73693 5.00433 9.17653 12.3382 6.14323 13.0621 10.3972 8.29262 10.7813 5.82131 numMergedOcc 0
