0 mol 54 unq 0 iso 0 dist 7.62814 10.3846 6.89022 8.7388 10.1455 6.32568 numMergedOcc 0
1 mol 81 unq 0 iso 0 dist 9.61504 9.52356 8.36954 11.6761 3.57472 8.5843 numMergedOcc 0
2 mol 91 unq 0 iso 0 dist 4.77363 4.95433 5.16779 8.2802 3.57191 7.77766 numMergedOcc 0
3 mol 131 unq 0 iso 0 dist 7.382 8.74922 9.8911 10.9017 4.60864 9.66687 numMergedOcc 0
4 mol 131 unq 1 iso 0 dist 7.382 4.95238 7.02043 10.9017 4.60864 9.68242 numMergedOcc 0
5 mol 141 unq 0 iso 0 dist 4.93944 12.9884 8.56285 7.66512 3.80087 7.90709 numMergedOcc 0
6 mol 141 unq 1 iso 0 dist 4.93944 12.9884 8.56285 7.38183 3.80763 9.03842 numMergedOcc 0
7 mol 154 unq 0 iso 0 dist 8.23311 7.974 5.53933 9.7931 4.03185 6.84471 numMergedOcc 0
8 mol 154 unq 1 iso 0 dist 6.1247 4.33412 5.53933 5.76862 4.03185 6.84471 numMergedOcc 0
9 mol 231 unq 0 iso 0 dist 6.8533 4.18904 5.45266 10.7108 4.02097 8.68815 numMergedOcc 0
10 mol 252 unq 0 iso 0 dist 7.38867 13.2785 8.63893 9.1191 3.99887 7.89384 numMergedOcc 0
11 mol 254 unq 0 iso 0 dist 8.87934 6.89801 6.56151 12.5377 4.4384 9.43169 numMergedOcc 0
12 mol 254 unq 1 iso 0 dist 8.87934 9.83174 6.58752 12.5377 4.4384 5.9438 numMergedOcc 0
13 mol 254 unq 2 iso 0 dist 9.66687 6.89801 8.3417 12.5377 6.09569 9.43169 numMergedOcc 0
14 mol 254 unq 3 iso 0 dist 9.47133 12.4202 6.56151 13.2437 4.4384 9.43169 numMergedOcc 0
15 mol 254 unq 4 iso 0 dist 9.47133 14.4667 6.58752 13.2437 4.4384 5.9438 numMergedOcc 0
16 mol 254 unq 5 iso 0 dist 7.61537 12.4202 8.3417 13.2437 6.09569 9.43169 numMergedOcc 0
17 mol 257 unq 0 iso 0 dist 8.81508 4.52088 8.86142 6.8256 8.63927 8.48733 numMergedOcc 0
18 mol 261 unq 0 iso 0 dist 9.90119 5.02504 9.39727 12.9438 10.196 9.57431 numMergedOcc 0
19 mol 261 unq 1 iso 0 dist 9.90119 4.34203 7.8647 13.3611 6.46193 9.53126 numMergedOcc 0
20 mol 283 unq 0 iso 0 dist 9.33601 8.33215 9.90494 13.8503 13.6429 7.36223 numMergedOcc 0
