0 mol 51 unq 0 iso 0 dist 7.01107 4.48244 8.49879 9.42746 9.11764 5.97456 numMergedOcc 0
1 mol 62 unq 0 iso 0 dist 8.32519 8.33049 6.35779 7.751 9.19512 5.46563 numMergedOcc 0
2 mol 68 unq 0 iso 0 dist 7.51631 9.04231 5.57551 4.60844 8.19932 6.56256 numMergedOcc 0
3 mol 68 unq 1 iso 0 dist 4.9983 5.16912 8.18214 3.62638 5.64092 6.4113 numMergedOcc 0
4 mol 69 unq 0 iso 0 dist 5.38363 11.5849 9.56859 5.29207 9.08745 11.7024 numMergedOcc 0
5 mol 69 unq 1 iso 0 dist 5.38363 5.10938 5.75135 5.29207 9.08745 4.69809 numMergedOcc 0
6 mol 101 unq 0 iso 0 dist 9.05284 4.69492 6.67863 12.1065 9.33112 13.2642 numMergedOcc 0
7 mol 113 unq 0 iso 0 dist 6.36631 8.77924 7.96893 13.8532 8.67025 8.60362 numMergedOcc 0
8 mol 169 unq 0 iso 0 dist 6.85177 9.83306 7.50458 5.68862 7.65903 6.22697 numMergedOcc 0
9 mol 169 unq 1 iso 0 dist 8.88729 9.83306 5.79554 5.68862 5.97653 6.22697 numMergedOcc 0
10 mol 169 unq 2 iso 0 dist 7.07933 14.3008 7.33643 6.43144 9.06172 14.6592 numMergedOcc 0
11 mol 169 unq 3 iso 0 dist 7.07933 14.3008 7.33643 6.37039 8.93091 14.9735 numMergedOcc 0
12 mol 184 unq 0 iso 0 dist 8.77932 3.76321 9.10344 8.04827 7.25623 6.60692 numMergedOcc 0
13 mol 205 unq 0 iso 0 dist 9.2814 11.5663 8.25174 8.70638 7.4185 7.54616 numMergedOcc 0
14 mol 205 unq 1 iso 0 dist 9.2814 10.3557 9.16671 8.70638 7.4185 3.69062 numMergedOcc 0
15 mol 254 unq 0 iso 0 dist 8.80049 9.90043 7.89302 5.08612 5.6417 5.06168 numMergedOcc 0
16 mol 254 unq 1 iso 0 dist 8.80049 9.90043 7.89302 5.81569 7.42831 6.25965 numMergedOcc 0
17 mol 260 unq 0 iso 0 dist 4.54064 9.30964 7.88108 4.87707 8.51564 9.0549 numMergedOcc 0
18 mol 260 unq 1 iso 0 dist 5.33881 13.8952 9.46576 9.31424 9.73217 17.1277 numMergedOcc 0
19 mol 260 unq 2 iso 0 dist 5.33881 13.8952 9.46576 10.8164 7.49606 6.73886 numMergedOcc 0
20 mol 260 unq 3 iso 0 dist 5.33881 13.8952 9.46576 8.53278 8.06377 11.1586 numMergedOcc 0
21 mol 285 unq 0 iso 0 dist 5.93983 9.78456 6.73396 7.67857 7.73438 6.01574 numMergedOcc 0
