0 mol 10 unq 0 iso 0 dist 9.31452 6.50444 4.75564 5.68247 12.3172 7.82875 numMergedOcc 0
1 mol 12 unq 0 iso 0 dist 8.99098 9.79847 15.3098 4.60834 13.3275 8.18139 numMergedOcc 0
2 mol 28 unq 0 iso 0 dist 7.43758 9.3223 6.51818 4.24515 8.24422 9.4148 numMergedOcc 0
3 mol 28 unq 1 iso 0 dist 7.43758 9.3223 6.51818 5.03315 8.99724 6.87842 numMergedOcc 0
4 mol 63 unq 0 iso 0 dist 9.99115 8.28839 10.9175 3.86843 12.1217 6.04797 numMergedOcc 0
5 mol 63 unq 1 iso 0 dist 9.99115 7.07396 5.4638 3.86843 12.1217 8.88058 numMergedOcc 0
6 mol 79 unq 0 iso 0 dist 9.96175 8.57705 9.32786 4.95628 12.5272 7.79538 numMergedOcc 0
7 mol 79 unq 1 iso 0 dist 6.96066 7.58743 10.8503 4.20398 10.9396 7.318 numMergedOcc 0
8 mol 81 unq 0 iso 0 dist 7.41802 5.73799 4.85657 10.4407 11.2332 9.4072 numMergedOcc 0
9 mol 155 unq 0 iso 0 dist 7.49276 7.25009 10.541 5.49557 9.06599 8.99128 numMergedOcc 0
10 mol 186 unq 0 iso 0 dist 8.52322 6.52441 11.5572 7.99002 16.0086 6.84679 numMergedOcc 0
11 mol 195 unq 0 iso 0 dist 9.39697 9.48766 9.72539 10.6976 14.1219 8.84149 numMergedOcc 0
12 mol 195 unq 1 iso 0 dist 4.86882 9.48766 5.49738 10.6976 9.59601 8.84149 numMergedOcc 0
13 mol 238 unq 0 iso 0 dist 5.83646 7.13727 4.48114 5.64173 7.75366 5.52788 numMergedOcc 0
14 mol 239 unq 0 iso 0 dist 9.87224 7.63381 8.15025 17.1937 16.3204 9.993 numMergedOcc 0
15 mol 279 unq 0 iso 0 dist 8.34154 7.59142 7.51644 15.1753 13.774 8.34313 numMergedOcc 0
16 mol 279 unq 1 iso 0 dist 9.07176 7.59142 3.75346 15.1753 10.4088 8.34313 numMergedOcc 0
17 mol 279 unq 2 iso 0 dist 5.90456 7.59142 5.03816 15.1753 11.6898 8.34313 numMergedOcc 0
18 mol 283 unq 0 iso 0 dist 5.96202 7.81241 5.83652 4.01355 6.93798 5.32876 numMergedOcc 0
19 mol 283 unq 1 iso 0 dist 5.96202 9.52445 5.99759 4.01355 6.93798 7.60296 numMergedOcc 0
