0 mol 1 unq 0 iso 0 dist 9.72447 15.3182 6.06669 12.0811 5.74199 5.1888 numMergedOcc 0
1 mol 62 unq 0 iso 0 dist 9.42975 5.4222 7.30392 9.35373 7.61631 10.9933 numMergedOcc 0
2 mol 69 unq 0 iso 0 dist 4.49869 4.64534 7.33546 5.87879 9.22636 7.83359 numMergedOcc 0
3 mol 114 unq 0 iso 0 dist 9.26301 14.683 5.66196 12.5962 5.31281 5.6579 numMergedOcc 0
4 mol 114 unq 1 iso 0 dist 9.26301 14.683 5.66196 17.733 8.9922 4.77912 numMergedOcc 0
5 mol 148 unq 0 iso 0 dist 6.17633 6.35578 5.86949 9.59882 9.71692 6.33907 numMergedOcc 0
6 mol 148 unq 1 iso 0 dist 6.17633 9.28852 6.72591 9.59882 9.71692 7.50382 numMergedOcc 0
7 mol 148 unq 2 iso 0 dist 9.32264 6.16086 5.86949 9.435 9.71692 6.33907 numMergedOcc 0
8 mol 148 unq 3 iso 0 dist 9.32264 12.2447 6.72591 9.435 9.71692 7.50382 numMergedOcc 0
9 mol 150 unq 0 iso 0 dist 6.20295 6.38431 5.84971 9.57563 9.73708 6.43607 numMergedOcc 0
10 mol 150 unq 1 iso 0 dist 6.20295 9.28339 6.80192 9.57563 9.73708 7.48524 numMergedOcc 0
11 mol 150 unq 2 iso 0 dist 9.34249 6.11114 5.84971 9.39127 9.73708 6.43607 numMergedOcc 0
12 mol 150 unq 3 iso 0 dist 9.34249 12.2778 6.80192 9.39127 9.73708 7.48524 numMergedOcc 0
13 mol 160 unq 0 iso 0 dist 8.83016 5.48551 5.13415 7.32507 8.87648 4.29308 numMergedOcc 0
14 mol 189 unq 0 iso 0 dist 8.51507 8.08721 9.71306 4.92782 5.11059 6.58275 numMergedOcc 0
15 mol 204 unq 0 iso 0 dist 9.12896 6.34282 4.90334 8.40223 7.00683 6.42715 numMergedOcc 0
16 mol 204 unq 1 iso 0 dist 8.63667 4.34433 4.90334 10.3245 7.00683 6.42715 numMergedOcc 0
17 mol 211 unq 0 iso 0 dist 8.63677 4.98164 5.02094 14.0337 9.8921 9.43858 numMergedOcc 0
18 mol 211 unq 1 iso 0 dist 8.63677 4.98164 5.02094 6.35096 8.50841 4.19883 numMergedOcc 0
19 mol 212 unq 0 iso 0 dist 8.53152 5.3488 8.02266 13.207 9.26387 10.6347 numMergedOcc 0
20 mol 214 unq 0 iso 0 dist 8.67902 6.11845 5.12798 13.4896 9.81136 7.70847 numMergedOcc 0
21 mol 214 unq 1 iso 0 dist 8.67902 6.11845 5.12798 8.50143 7.25293 6.52672 numMergedOcc 0
22 mol 245 unq 0 iso 0 dist 5.70624 8.55335 7.1207 4.84566 7.26913 5.75694 numMergedOcc 0
23 mol 245 unq 1 iso 0 dist 5.70624 8.55335 7.1207 11.4898 6.41862 6.87827 numMergedOcc 0
24 mol 245 unq 2 iso 0 dist 5.70624 8.55335 7.1207 13.484 8.69377 9.93908 numMergedOcc 0
25 mol 259 unq 0 iso 0 dist 9.98041 8.316 6.6238 11.5702 6.76656 5.48962 numMergedOcc 0
26 mol 279 unq 0 iso 0 dist 9.72665 7.79897 5.00402 4.80106 9.98985 10.1637 numMergedOcc 0
27 mol 279 unq 1 iso 0 dist 9.72665 7.79897 5.00402 5.29536 7.22295 5.61514 numMergedOcc 0
28 mol 285 unq 0 iso 0 dist 4.9851 5.45657 4.09984 4.21241 8.70702 9.64395 numMergedOcc 0
29 mol 285 unq 1 iso 0 dist 4.9851 5.45657 4.09984 11.6648 9.43706 10.5268 numMergedOcc 0
30 mol 285 unq 2 iso 0 dist 4.9851 5.45657 4.09984 10.4106 9.3482 6.59466 numMergedOcc 0
