0 mol 8 unq 0 iso 0 dist 5.89089 5.54963 9.06222 8.10061 6.56356 11.9427 numMergedOcc 0
1 mol 76 unq 0 iso 0 dist 5.17291 8.32084 9.19402 8.27493 9.13322 15.1746 numMergedOcc 0
2 mol 76 unq 1 iso 0 dist 8.81569 7.3009 9.19402 12.0737 9.13322 15.1746 numMergedOcc 0
3 mol 78 unq 0 iso 0 dist 8.40871 11.692 9.80802 10.8182 6.85523 9.93158 numMergedOcc 0
4 mol 78 unq 1 iso 0 dist 8.40871 11.692 9.80802 3.48199 5.77326 11.5941 numMergedOcc 0
5 mol 112 unq 0 iso 0 dist 9.13413 5.0709 5.43031 11.7536 8.47988 8.3383 numMergedOcc 0
6 mol 112 unq 1 iso 0 dist 9.13413 5.0709 5.43031 5.8662 8.0427 5.07427 numMergedOcc 0
7 mol 131 unq 0 iso 0 dist 7.49404 5.90585 9.20372 7.08715 9.27976 6.764 numMergedOcc 0
8 mol 133 unq 0 iso 0 dist 7.85025 11.4126 6.2109 13.4842 8.77023 6.10716 numMergedOcc 0
9 mol 186 unq 0 iso 0 dist 6.20985 5.63677 5.39213 5.74845 8.73533 10.6602 numMergedOcc 0
10 mol 186 unq 1 iso 0 dist 7.69466 7.09954 5.39213 5.60861 8.73533 10.6602 numMergedOcc 0
11 mol 197 unq 0 iso 0 dist 7.18765 14.9572 9.24777 4.26432 9.10817 15.546 numMergedOcc 0
12 mol 197 unq 1 iso 0 dist 7.18765 14.9572 9.24777 14.0652 9.73548 9.12935 numMergedOcc 0
13 mol 259 unq 0 iso 0 dist 9.89728 17.9599 9.07855 13.7396 5.85442 11.2726 numMergedOcc 0
14 mol 259 unq 1 iso 0 dist 9.89728 17.9599 9.07855 15.7491 6.95511 9.26271 numMergedOcc 0
15 mol 277 unq 0 iso 0 dist 6.86014 4.94857 8.61945 11.4058 9.35539 12.6855 numMergedOcc 0
16 mol 277 unq 1 iso 0 dist 6.86014 4.94857 8.61945 14.6762 8.9682 15.9144 numMergedOcc 0
17 mol 277 unq 2 iso 0 dist 6.86014 4.94857 8.61945 11.68 6.92711 13.156 numMergedOcc 0
18 mol 277 unq 3 iso 0 dist 5.97073 13.4694 8.61945 6.9003 9.35539 12.6855 numMergedOcc 0
19 mol 277 unq 4 iso 0 dist 5.97073 13.4694 8.61945 11.3103 8.9682 15.9144 numMergedOcc 0
20 mol 277 unq 5 iso 0 dist 5.97073 13.4694 8.61945 10.5734 6.92711 13.156 numMergedOcc 0
21 mol 277 unq 6 iso 0 dist 6.49176 15.096 8.61945 11.7592 9.35539 12.6855 numMergedOcc 0
22 mol 277 unq 7 iso 0 dist 6.49176 15.096 8.61945 6.40883 8.9682 15.9144 numMergedOcc 0
23 mol 277 unq 8 iso 0 dist 6.49176 15.096 8.61945 6.79352 6.92711 13.156 numMergedOcc 0
