0 mol 67 unq 0 iso 0 dist 9.67476 12.9986 8.27009 18.1608 10.6111 6.04303 numMergedOcc 0
1 mol 67 unq 1 iso 0 dist 9.67476 12.9986 8.27009 14.7264 6.9953 6.12267 numMergedOcc 0
2 mol 67 unq 2 iso 0 dist 9.77899 8.81994 6.04303 9.10105 5.55985 6.12267 numMergedOcc 0
3 mol 67 unq 3 iso 0 dist 9.77899 8.81994 6.04303 14.611 10.6111 8.27009 numMergedOcc 0
4 mol 67 unq 4 iso 0 dist 9.77899 4.89257 7.15248 9.10105 5.55985 8.43162 numMergedOcc 0
5 mol 67 unq 5 iso 0 dist 9.10105 8.81994 6.12267 9.77899 5.55985 6.04303 numMergedOcc 0
6 mol 67 unq 6 iso 0 dist 9.10105 8.81994 6.12267 14.611 6.9953 8.27009 numMergedOcc 0
7 mol 67 unq 7 iso 0 dist 9.10105 4.89257 8.43162 9.77899 5.55985 7.15248 numMergedOcc 0
8 mol 73 unq 0 iso 0 dist 7.37476 4.50556 9.47045 10.8557 11.7643 8.07498 numMergedOcc 0
9 mol 73 unq 1 iso 0 dist 7.37476 4.53367 8.68218 10.8557 11.7643 7.46419 numMergedOcc 0
10 mol 76 unq 0 iso 0 dist 7.52544 4.77004 5.73235 8.08674 10.0928 7.48127 numMergedOcc 0
11 mol 76 unq 1 iso 0 dist 8.08674 4.77004 7.48127 7.52544 10.0928 5.73235 numMergedOcc 0
12 mol 114 unq 0 iso 0 dist 8.80616 5.64342 8.57909 11.4105 8.36743 6.54778 numMergedOcc 0
13 mol 115 unq 0 iso 0 dist 6.17589 8.7758 9.41083 9.59458 5.54133 9.67606 numMergedOcc 0
14 mol 148 unq 0 iso 0 dist 6.17633 8.47619 9.18753 14.398 10.8037 8.6953 numMergedOcc 0
15 mol 148 unq 1 iso 0 dist 9.32264 12.407 9.18753 18.5989 10.8037 8.6953 numMergedOcc 0
16 mol 150 unq 0 iso 0 dist 6.20295 8.33704 9.15244 14.3514 10.8647 8.65967 numMergedOcc 0
17 mol 150 unq 1 iso 0 dist 9.34249 12.3632 9.15244 18.628 10.8647 8.65967 numMergedOcc 0
18 mol 182 unq 0 iso 0 dist 8.25297 9.56793 6.38335 17.5613 11.427 8.27913 numMergedOcc 0
19 mol 182 unq 1 iso 0 dist 8.25297 9.56793 6.38335 14.9045 9.71185 8.85111 numMergedOcc 0
20 mol 189 unq 0 iso 0 dist 8.51507 6.00118 9.95686 11.6023 8.91303 7.54658 numMergedOcc 0
21 mol 189 unq 1 iso 0 dist 8.51507 5.48787 9.47321 10.5148 8.74557 6.38294 numMergedOcc 0
22 mol 211 unq 0 iso 0 dist 7.49132 11.2256 8.10779 11.3349 5.59365 5.6998 numMergedOcc 0
23 mol 220 unq 0 iso 0 dist 9.64006 4.47683 8.57174 10.2603 12.1405 6.80214 numMergedOcc 0
24 mol 239 unq 0 iso 0 dist 8.4319 10.3585 7.58554 12.3416 7.99748 8.26312 numMergedOcc 0
25 mol 245 unq 0 iso 0 dist 5.70624 12.1537 7.95061 20.1287 15.2703 9.5096 numMergedOcc 0
26 mol 258 unq 0 iso 0 dist 9.27225 11.1283 8.58092 16.1106 8.76629 7.53199 numMergedOcc 0
27 mol 258 unq 1 iso 0 dist 9.27225 11.1283 8.58092 12.0657 5.64447 7.40014 numMergedOcc 0
28 mol 266 unq 0 iso 0 dist 8.78501 8.96584 9.39714 13.7111 13.1611 6.57444 numMergedOcc 0
29 mol 277 unq 0 iso 0 dist 9.60879 4.00063 6.66936 6.92271 11.3688 8.15119 numMergedOcc 0
30 mol 277 unq 1 iso 0 dist 6.92271 4.00063 8.15119 9.60879 11.3688 6.66936 numMergedOcc 0
31 mol 277 unq 2 iso 0 dist 8.62666 9.31316 8.15119 12.8843 11.3688 6.66936 numMergedOcc 0
32 mol 294 unq 0 iso 0 dist 8.92737 9.82894 6.37998 16.9157 8.23817 9.77023 numMergedOcc 0
33 mol 294 unq 1 iso 0 dist 7.15278 6.49126 6.37998 14.2958 8.23817 9.77023 numMergedOcc 0
