0 mol 10 unq 0 iso 0 dist 9.90359 5.45654 8.13471 5.99743 7.50126 8.00369 numMergedOcc 0
1 mol 98 unq 0 iso 0 dist 9.45186 9.70366 7.63183 13.9717 9.50457 6.62972 numMergedOcc 0
2 mol 98 unq 1 iso 0 dist 8.6964 7.63357 7.63183 13.1306 9.50457 6.62972 numMergedOcc 0
3 mol 131 unq 0 iso 0 dist 7.61392 9.01144 7.76594 10.6783 5.67023 5.44303 numMergedOcc 0
4 mol 131 unq 1 iso 0 dist 7.61392 9.01144 7.76594 15.3353 10.9757 8.50562 numMergedOcc 0
5 mol 131 unq 2 iso 0 dist 9.13081 15.064 7.76594 10.9017 5.67023 5.44303 numMergedOcc 0
6 mol 131 unq 3 iso 0 dist 9.13081 15.064 7.76594 13.8214 10.9757 8.50562 numMergedOcc 0
7 mol 141 unq 0 iso 0 dist 5.77628 10.8036 8.93453 7.66512 9.21506 9.78667 numMergedOcc 0
8 mol 141 unq 1 iso 0 dist 5.77628 10.8036 8.93453 7.38183 4.38393 6.73983 numMergedOcc 0
9 mol 141 unq 2 iso 0 dist 5.77628 10.8036 8.93453 11.3573 6.06881 7.64956 numMergedOcc 0
10 mol 156 unq 0 iso 0 dist 9.40992 9.19636 5.90883 16.3623 11.3995 7.46845 numMergedOcc 0
11 mol 156 unq 1 iso 0 dist 7.44879 13.3524 5.90883 18.1114 11.3995 7.46845 numMergedOcc 0
12 mol 156 unq 2 iso 0 dist 7.64275 13.3524 8.06913 18.1114 11.6326 7.46845 numMergedOcc 0
13 mol 171 unq 0 iso 0 dist 9.7578 14.3134 9.75627 19.9605 11.6944 8.1536 numMergedOcc 0
14 mol 171 unq 1 iso 0 dist 6.27462 12.4068 7.82546 12.0583 6.29877 7.32555 numMergedOcc 0
15 mol 171 unq 2 iso 0 dist 9.85967 8.98068 9.75627 11.2168 11.6944 8.1536 numMergedOcc 0
16 mol 186 unq 0 iso 0 dist 6.58421 8.71876 7.55358 16.0882 13.1254 7.46987 numMergedOcc 0
17 mol 186 unq 1 iso 0 dist 9.03496 5.37893 7.23293 8.09667 5.91678 5.45675 numMergedOcc 0
18 mol 193 unq 0 iso 0 dist 7.46207 11.6364 5.44396 6.28889 3.98356 8.67745 numMergedOcc 0
19 mol 193 unq 1 iso 0 dist 7.46207 8.4769 6.22972 6.28889 3.98356 9.41624 numMergedOcc 0
20 mol 218 unq 0 iso 0 dist 9.27651 11.3699 8.93185 14.8197 9.99277 8.3087 numMergedOcc 0
21 mol 264 unq 0 iso 0 dist 9.54836 10.1582 5.74568 17.2364 11.5512 7.21655 numMergedOcc 0
22 mol 286 unq 0 iso 0 dist 6.99185 6.85637 5.91064 13.4578 7.09114 8.69826 numMergedOcc 0
