0 mol 13 unq 0 iso 0 dist 8.05984 6.67016 9.11447 14.9969 14.2112 8.43325 14.9058 17.3812 9.75022 9.45635 numMergedOcc 0
1 mol 130 unq 0 iso 0 dist 9.03277 12.6692 6.42785 17.2149 8.84655 8.33077 15.8079 10.1252 6.76477 6.93139 numMergedOcc 0
2 mol 154 unq 0 iso 0 dist 8.583 9.16009 6.28417 14.5291 6.53652 7.72144 22.2478 14.6576 14.4682 8.33439 numMergedOcc 0
3 mol 159 unq 0 iso 0 dist 9.66843 8.3352 7.13269 13.074 4.57561 7.25742 12.5564 10.7736 5.34453 9.36259 numMergedOcc 0
4 mol 175 unq 0 iso 0 dist 6.84347 10.9098 7.01126 11.4946 11.1651 7.35824 14.4136 11.9429 5.68406 9.63417 numMergedOcc 0
5 mol 175 unq 1 iso 0 dist 6.84347 5.31207 6.58434 11.4946 11.1651 9.17364 14.4136 11.9429 9.31641 9.63417 numMergedOcc 0
6 mol 178 unq 0 iso 0 dist 8.3134 8.88917 5.98771 12.1615 5.25267 4.92088 14.8286 11.7594 7.79894 9.11204 numMergedOcc 0
7 mol 178 unq 1 iso 0 dist 5.20764 5.49143 5.98771 8.0974 5.25267 4.92088 9.80877 11.7594 7.79894 9.11204 numMergedOcc 0
8 mol 184 unq 0 iso 0 dist 5.59438 6.78683 6.21206 10.2743 6.47974 8.77887 13.4408 10.9394 6.88536 9.90822 numMergedOcc 0
9 mol 184 unq 1 iso 0 dist 5.59438 6.78683 6.21206 10.2743 6.47974 8.77887 7.12599 7.59939 6.19242 6.73504 numMergedOcc 0
10 mol 195 unq 0 iso 0 dist 8.55725 10.7217 9.79691 15.1561 13.6975 6.60567 18.0124 18.9952 9.48862 7.41662 numMergedOcc 0
11 mol 195 unq 1 iso 0 dist 8.55725 10.7217 9.79691 12.8586 6.08211 7.62942 15.4272 12.3988 8.89297 9.03441 numMergedOcc 0
12 mol 214 unq 0 iso 0 dist 6.35728 5.20422 5.10114 8.49704 6.67959 6.38157 4.112 8.70987 5.73082 7.46481 numMergedOcc 0
13 mol 277 unq 0 iso 0 dist 6.73204 8.7465 7.25677 10.9325 9.92201 6.57903 13.3706 15.7984 14.6871 9.57499 numMergedOcc 0
