0 mol 7 unq 0 iso 0 dist 5.77374 8.57437 5.63739 7.49627 6.27507 11.4058 numMergedOcc 0
1 mol 7 unq 1 iso 0 dist 8.57437 5.77374 5.63739 9.21239 7.22054 10.6787 numMergedOcc 0
2 mol 73 unq 0 iso 0 dist 5.68726 9.78545 6.18163 12.9392 9.62026 13.7641 numMergedOcc 0
3 mol 73 unq 1 iso 0 dist 7.46882 9.97998 6.18163 9.77115 9.62026 13.7641 numMergedOcc 0
4 mol 88 unq 0 iso 0 dist 9.4046 9.47957 5.60823 4.46644 9.3278 10.9014 numMergedOcc 0
5 mol 119 unq 0 iso 0 dist 6.67306 9.2167 7.15643 10.0813 9.53895 15.8979 numMergedOcc 0
6 mol 183 unq 0 iso 0 dist 9.86506 7.86724 8.9952 5.86369 6.0033 9.51612 numMergedOcc 0
7 mol 183 unq 1 iso 0 dist 9.86506 7.86724 8.9952 4.44329 9.01322 5.89091 numMergedOcc 0
8 mol 183 unq 2 iso 0 dist 9.86506 7.85507 15.9375 5.86369 6.0033 12.2374 numMergedOcc 0
9 mol 183 unq 3 iso 0 dist 9.86506 7.85507 15.9375 4.44329 9.01322 12.2148 numMergedOcc 0
10 mol 183 unq 4 iso 0 dist 5.83335 9.92635 14.4206 8.4495 9.51612 12.2374 numMergedOcc 0
11 mol 183 unq 5 iso 0 dist 5.83335 9.92635 14.4206 3.94874 5.89091 12.2148 numMergedOcc 0
12 mol 183 unq 6 iso 0 dist 7.86724 9.86506 8.9952 5.86369 9.51612 6.0033 numMergedOcc 0
13 mol 183 unq 7 iso 0 dist 7.86724 9.86506 8.9952 4.44329 5.89091 9.01322 numMergedOcc 0
14 mol 183 unq 8 iso 0 dist 7.86724 7.85507 14.4206 5.86369 9.51612 12.2374 numMergedOcc 0
15 mol 183 unq 9 iso 0 dist 7.86724 7.85507 14.4206 4.44329 5.89091 12.2148 numMergedOcc 0
16 mol 244 unq 0 iso 0 dist 9.21743 6.06284 5.61236 5.11447 9.52779 5.97452 numMergedOcc 0
17 mol 244 unq 1 iso 0 dist 6.06284 9.21743 5.61236 9.08474 8.95246 11.4038 numMergedOcc 0
18 mol 244 unq 2 iso 0 dist 6.06284 9.21743 5.61236 5.11447 5.97452 9.52779 numMergedOcc 0
19 mol 259 unq 0 iso 0 dist 7.97113 5.22111 4.70261 4.95084 9.06386 6.66413 numMergedOcc 0
20 mol 259 unq 1 iso 0 dist 5.22111 7.97113 4.70261 4.95084 6.66413 9.06386 numMergedOcc 0
21 mol 259 unq 2 iso 0 dist 8.38479 8.53598 4.70261 6.85606 9.06386 6.66413 numMergedOcc 0
22 mol 259 unq 3 iso 0 dist 8.53598 8.38479 4.70261 6.85606 6.66413 9.06386 numMergedOcc 0
23 mol 266 unq 0 iso 0 dist 3.90274 7.49024 9.45269 6.99177 8.67354 13.7289 numMergedOcc 0
24 mol 274 unq 0 iso 0 dist 7.62562 8.15217 6.07831 10.7766 9.70022 15.1079 numMergedOcc 0
25 mol 280 unq 0 iso 0 dist 7.10723 8.01368 9.14734 13.4787 9.93207 18.6933 numMergedOcc 0
