0 mol 17 unq 0 iso 0 dist 8.62221 5.04858 4.64234 13.4304 9.33795 9.82691 numMergedOcc 0
1 mol 17 unq 1 iso 0 dist 9.84476 5.04858 6.26254 13.4304 7.15292 9.82691 numMergedOcc 0
2 mol 59 unq 0 iso 0 dist 7.92225 15.8839 9.34271 10.5448 7.57153 8.17564 numMergedOcc 0
3 mol 59 unq 1 iso 0 dist 7.92225 5.90701 8.69574 10.5448 7.57153 6.94351 numMergedOcc 0
4 mol 103 unq 0 iso 0 dist 7.85115 6.21393 5.53454 8.68825 3.56771 8.42487 numMergedOcc 0
5 mol 119 unq 0 iso 0 dist 9.11123 12.8846 8.42225 12.7315 3.71283 8.95838 numMergedOcc 0
6 mol 123 unq 0 iso 0 dist 8.09329 7.43229 8.30974 9.14195 6.04079 6.7201 numMergedOcc 0
7 mol 123 unq 1 iso 0 dist 6.13025 7.19969 8.30974 6.0636 6.04079 6.7201 numMergedOcc 0
8 mol 148 unq 0 iso 0 dist 8.99827 5.92269 6.81449 6.3102 10.129 8.07915 numMergedOcc 0
9 mol 150 unq 0 iso 0 dist 8.97634 5.95123 6.87593 6.25629 9.97049 7.97801 numMergedOcc 0
10 mol 184 unq 0 iso 0 dist 9.35481 7.11382 7.65214 5.87728 8.28234 9.554 numMergedOcc 0
11 mol 210 unq 0 iso 0 dist 9.72463 17.8528 9.49242 14.3648 5.35359 6.87234 numMergedOcc 0
12 mol 210 unq 1 iso 0 dist 9.72463 17.8528 9.49242 20.4272 10.8507 8.72017 numMergedOcc 0
13 mol 247 unq 0 iso 0 dist 5.27761 5.45251 4.78189 9.16641 6.27561 9.76925 numMergedOcc 0
14 mol 269 unq 0 iso 0 dist 6.53779 4.50547 6.72096 11.5792 9.20524 9.92223 numMergedOcc 0
15 mol 269 unq 1 iso 0 dist 6.53779 4.50547 6.72096 7.37926 5.98901 5.98602 numMergedOcc 0
16 mol 269 unq 2 iso 0 dist 6.53779 5.57581 9.18157 7.37926 5.98901 9.78238 numMergedOcc 0
17 mol 269 unq 3 iso 0 dist 6.02501 6.37646 6.72096 14.0738 9.20524 9.92223 numMergedOcc 0
18 mol 269 unq 4 iso 0 dist 6.02501 6.37646 6.72096 10.0042 5.98901 5.98602 numMergedOcc 0
19 mol 269 unq 5 iso 0 dist 6.02501 8.94147 9.18157 10.0042 5.98901 9.78238 numMergedOcc 0
20 mol 285 unq 0 iso 0 dist 6.94666 6.61129 6.73396 5.32578 6.01515 8.96754 numMergedOcc 0
21 mol 287 unq 0 iso 0 dist 8.08382 7.88871 7.84189 10.552 11.7964 9.94507 numMergedOcc 0
22 mol 288 unq 0 iso 0 dist 8.08382 7.88871 7.84189 10.552 11.7964 9.94507 numMergedOcc 0
23 mol 289 unq 0 iso 0 dist 8.08382 7.88871 7.84189 10.552 11.7964 9.94507 numMergedOcc 0
