0 mol 96 unq 0 iso 0 dist 6.21351 7.31203 9.93617 7.06723 5.92032 11.809 numMergedOcc 0
1 mol 96 unq 0 iso 1 dist 9.93617 7.31203 6.21351 11.809 5.92032 7.06723 numMergedOcc 0
2 mol 98 unq 0 iso 0 dist 9.83528 6.49254 7.54969 5.90298 7.26086 8.8736 numMergedOcc 0
3 mol 98 unq 0 iso 1 dist 7.54969 6.49254 9.83528 8.8736 7.26086 5.90298 numMergedOcc 0
4 mol 109 unq 0 iso 0 dist 9.26438 10.3911 6.43255 12.3653 5.34214 5.55157 numMergedOcc 0
5 mol 109 unq 0 iso 1 dist 6.43255 10.3911 9.26438 5.55157 5.34214 12.3653 numMergedOcc 0
6 mol 109 unq 1 iso 0 dist 9.26438 15.5356 7.4389 12.3653 5.34214 3.56506 numMergedOcc 0
7 mol 109 unq 1 iso 1 dist 7.4389 15.5356 9.26438 3.56506 5.34214 12.3653 numMergedOcc 0
8 mol 109 unq 1 iso 0 dist 6.43255 7.25431 7.4389 5.55157 5.34214 3.56506 numMergedOcc 0
9 mol 109 unq 1 iso 1 dist 7.4389 7.25431 6.43255 3.56506 5.34214 5.55157 numMergedOcc 0
10 mol 112 unq 0 iso 0 dist 7.85583 5.62795 8.86938 11.1422 6.47042 13.5573 numMergedOcc 0
11 mol 112 unq 0 iso 1 dist 8.86938 5.62795 7.85583 13.5573 6.47042 11.1422 numMergedOcc 0
12 mol 134 unq 0 iso 0 dist 4.9155 7.36102 8.49987 7.07077 5.53031 5.92316 numMergedOcc 0
13 mol 134 unq 0 iso 1 dist 8.49987 7.36102 4.9155 5.92316 5.53031 7.07077 numMergedOcc 0
14 mol 134 unq 1 iso 0 dist 4.9155 11.0847 9.42271 7.07077 5.53031 10.7289 numMergedOcc 0
15 mol 134 unq 1 iso 1 dist 9.42271 11.0847 4.9155 10.7289 5.53031 7.07077 numMergedOcc 0
16 mol 134 unq 1 iso 0 dist 8.49987 8.91755 9.42271 5.92316 5.53031 10.7289 numMergedOcc 0
17 mol 134 unq 1 iso 1 dist 9.42271 8.91755 8.49987 10.7289 5.53031 5.92316 numMergedOcc 0
18 mol 142 unq 0 iso 0 dist 8.86346 4.10205 4.93681 7.78477 9.17106 6.74129 numMergedOcc 0
19 mol 142 unq 0 iso 1 dist 4.93681 4.10205 8.86346 6.74129 9.17106 7.78477 numMergedOcc 0
20 mol 195 unq 0 iso 0 dist 7.39185 5.56507 4.78641 9.67099 6.60567 9.33058 numMergedOcc 0
21 mol 195 unq 0 iso 1 dist 4.78641 5.56507 7.39185 9.33058 6.60567 9.67099 numMergedOcc 0
22 mol 235 unq 0 iso 0 dist 5.60236 9.1359 9.03917 6.49782 6.39158 12.526 numMergedOcc 0
23 mol 235 unq 0 iso 1 dist 9.03917 9.1359 5.60236 12.526 6.39158 6.49782 numMergedOcc 0
24 mol 238 unq 0 iso 0 dist 6.94654 9.65483 8.89487 9.80929 7.61393 11.3332 numMergedOcc 0
25 mol 238 unq 0 iso 1 dist 8.89487 9.65483 6.94654 11.3332 7.61393 9.80929 numMergedOcc 0
26 mol 277 unq 0 iso 0 dist 7.151 11.3045 8.33977 6.63088 6.57903 14.3997 numMergedOcc 0
27 mol 277 unq 0 iso 1 dist 8.33977 11.3045 7.151 14.3997 6.57903 6.63088 numMergedOcc 0
28 mol 285 unq 0 iso 0 dist 9.82717 17.8765 8.33653 10.0774 5.31728 10.471 numMergedOcc 0
29 mol 285 unq 0 iso 1 dist 8.33653 17.8765 9.82717 10.471 5.31728 10.0774 numMergedOcc 0
30 mol 285 unq 1 iso 0 dist 9.82717 14.2565 6.44657 10.0774 5.31728 10.8587 numMergedOcc 0
31 mol 285 unq 1 iso 1 dist 6.44657 14.2565 9.82717 10.8587 5.31728 10.0774 numMergedOcc 0
32 mol 285 unq 1 iso 0 dist 8.33653 9.31107 6.44657 10.471 5.31728 10.8587 numMergedOcc 0
33 mol 285 unq 1 iso 1 dist 6.44657 9.31107 8.33653 10.8587 5.31728 10.471 numMergedOcc 0
