0 mol 32 unq 0 iso 0 dist 8.5448 8.88829 12.4304 3.24351 5.78231 8.91596 numMergedOcc 0
1 mol 69 unq 0 iso 0 dist 9.54529 9.60879 6.77896 4.46517 12.1183 9.83836 numMergedOcc 0
2 mol 69 unq 1 iso 0 dist 9.54529 9.60879 6.77896 4.5904 7.31881 9.58351 numMergedOcc 0
3 mol 69 unq 2 iso 0 dist 6.73908 9.61096 6.77896 7.79723 12.1183 9.83836 numMergedOcc 0
4 mol 69 unq 3 iso 0 dist 6.73908 9.61096 6.77896 4.63088 7.31881 9.58351 numMergedOcc 0
5 mol 102 unq 0 iso 0 dist 8.48829 5.79411 6.59891 6.52658 11.887 5.54256 numMergedOcc 0
6 mol 113 unq 0 iso 0 dist 8.44588 9.34456 7.77295 16.2029 9.68191 9.59585 numMergedOcc 0
7 mol 113 unq 1 iso 0 dist 8.44588 9.34456 7.77295 17.3247 15.2931 9.7073 numMergedOcc 0
8 mol 113 unq 2 iso 0 dist 9.16474 9.80191 5.89983 10.3632 13.2408 8.99912 numMergedOcc 0
9 mol 117 unq 0 iso 0 dist 6.98104 6.97244 6.3368 11.3762 12.5497 7.78789 numMergedOcc 0
10 mol 117 unq 1 iso 0 dist 6.98104 6.97244 6.3368 10.2106 5.94465 7.42146 numMergedOcc 0
11 mol 117 unq 2 iso 0 dist 8.56221 6.97244 7.31538 11.3762 11.3394 7.78789 numMergedOcc 0
12 mol 117 unq 3 iso 0 dist 8.56221 6.97244 7.31538 10.2106 14.5744 7.42146 numMergedOcc 0
13 mol 129 unq 0 iso 0 dist 5.51129 6.1421 5.57978 12.077 13.2 7.97548 numMergedOcc 0
14 mol 129 unq 1 iso 0 dist 5.51129 6.1421 5.57978 10.5094 13.6256 9.64164 numMergedOcc 0
15 mol 147 unq 0 iso 0 dist 9.47429 9.11046 7.29693 5.76262 10.9908 6.73617 numMergedOcc 0
16 mol 147 unq 1 iso 0 dist 9.47429 9.11046 7.29693 4.09924 12.1569 9.03544 numMergedOcc 0
17 mol 241 unq 0 iso 0 dist 5.65753 5.40961 7.9304 7.13208 11.6372 7.52531 numMergedOcc 0
18 mol 241 unq 1 iso 0 dist 7.31224 5.57621 7.9304 8.09397 11.6372 7.52531 numMergedOcc 0
19 mol 258 unq 0 iso 0 dist 7.38265 8.14812 5.29393 6.55101 4.98907 8.03012 numMergedOcc 0
20 mol 270 unq 0 iso 0 dist 8.36659 9.02113 4.26143 9.89802 11.2757 8.65354 numMergedOcc 0
21 mol 277 unq 0 iso 0 dist 8.22261 8.20217 8.52993 10.4891 15.137 7.42932 numMergedOcc 0
22 mol 277 unq 1 iso 0 dist 5.70701 8.20217 10.2752 10.4891 15.1493 7.42932 numMergedOcc 0
23 mol 278 unq 0 iso 0 dist 8.20213 6.23184 11.0893 6.96416 14.1355 5.35705 numMergedOcc 0
24 mol 294 unq 0 iso 0 dist 9.03579 5.71661 9.41638 4.63586 7.58948 8.88595 numMergedOcc 0
