0 mol 94 unq 0 iso 0 dist 8.96022 10.9793 9.33801 7.1623 7.89459 5.81332 numMergedOcc 0
1 mol 94 unq 1 iso 0 dist 8.75181 5.98154 9.33801 8.92413 7.89459 5.81332 numMergedOcc 0
2 mol 95 unq 0 iso 0 dist 9.90769 16.1065 8.54906 11.0096 7.88289 6.6292 numMergedOcc 0
3 mol 95 unq 1 iso 0 dist 9.90769 16.1065 8.54906 10.3117 9.01083 12.3193 numMergedOcc 0
4 mol 109 unq 0 iso 0 dist 6.929 9.2405 9.74643 6.28185 8.58044 5.5332 numMergedOcc 0
5 mol 122 unq 0 iso 0 dist 5.94669 7.25474 8.33083 5.89212 8.37808 12.4383 numMergedOcc 0
6 mol 131 unq 0 iso 0 dist 6.65519 14.5158 8.97145 4.88092 6.85062 14.257 numMergedOcc 0
7 mol 131 unq 1 iso 0 dist 6.65519 8.98239 6.5874 4.88092 6.85062 7.60371 numMergedOcc 0
8 mol 142 unq 0 iso 0 dist 6.90378 13.9474 7.57458 8.11604 9.2313 13.1936 numMergedOcc 0
9 mol 142 unq 1 iso 0 dist 6.90378 13.9474 7.57458 5.39629 7.73169 12.288 numMergedOcc 0
10 mol 142 unq 2 iso 0 dist 6.90378 13.9474 7.57458 5.4779 8.96657 14.2067 numMergedOcc 0
11 mol 253 unq 0 iso 0 dist 7.84754 5.19991 7.7993 14.7198 9.02271 13.0587 numMergedOcc 0
12 mol 253 unq 1 iso 0 dist 7.84754 10.2798 6.10761 14.7198 9.02271 4.70422 numMergedOcc 0
13 mol 253 unq 2 iso 0 dist 6.71362 5.69389 7.7993 9.60213 9.02271 13.0587 numMergedOcc 0
14 mol 253 unq 3 iso 0 dist 6.71362 5.15209 6.10761 9.60213 9.02271 4.70422 numMergedOcc 0
15 mol 259 unq 0 iso 0 dist 9.07855 9.43479 7.93997 15.5856 7.46176 14.8465 numMergedOcc 0
16 mol 264 unq 0 iso 0 dist 7.51284 6.1018 6.75305 11.5015 6.24356 10.0289 numMergedOcc 0
17 mol 272 unq 0 iso 0 dist 9.32985 11.3478 6.94346 7.59176 8.33638 9.58279 numMergedOcc 0
18 mol 272 unq 1 iso 0 dist 5.50002 13.6939 9.1118 10.4754 9.97651 11.082 numMergedOcc 0
19 mol 272 unq 2 iso 0 dist 5.50002 13.6939 9.1118 12.6468 8.46116 6.72149 numMergedOcc 0
20 mol 277 unq 0 iso 0 dist 8.61945 8.24608 6.90434 9.21781 9.7748 13.2927 numMergedOcc 0
21 mol 278 unq 0 iso 0 dist 8.8437 6.99311 9.82774 8.4608 8.44326 10.5903 numMergedOcc 0
