0 mol 26 unq 0 iso 0 dist 5.97065 8.69142 4.98603 8.4126 7.84204 11.7007 numMergedOcc 0
1 mol 54 unq 0 iso 0 dist 6.21143 9.46449 9.84993 5.15508 9.03391 11.0484 numMergedOcc 0
2 mol 70 unq 0 iso 0 dist 5.62294 6.13606 8.69313 5.00416 5.48202 10.008 numMergedOcc 0
3 mol 70 unq 1 iso 0 dist 7.99569 8.42287 8.69313 4.00828 5.48202 10.008 numMergedOcc 0
4 mol 114 unq 0 iso 0 dist 9.6785 9.84391 15.0649 8.14095 5.96977 10.9536 numMergedOcc 0
5 mol 154 unq 0 iso 0 dist 5.81632 8.85675 4.70993 5.71332 5.97134 8.90588 numMergedOcc 0
6 mol 184 unq 0 iso 0 dist 7.09847 6.71675 7.4793 4.23511 9.46392 10.9454 numMergedOcc 0
7 mol 205 unq 0 iso 0 dist 6.37411 6.32542 11.9538 12.0078 9.81165 15.0916 numMergedOcc 0
8 mol 205 unq 1 iso 0 dist 6.37411 6.32542 11.9538 8.82295 7.8423 14.3465 numMergedOcc 0
9 mol 205 unq 2 iso 0 dist 6.37411 6.32542 11.9538 3.30102 7.74029 5.59832 numMergedOcc 0
10 mol 209 unq 0 iso 0 dist 5.20111 9.17634 4.68679 4.41097 8.62439 11.8646 numMergedOcc 0
11 mol 213 unq 0 iso 0 dist 4.80429 9.65238 6.17282 4.88386 6.8984 10.7796 numMergedOcc 0
12 mol 213 unq 1 iso 0 dist 6.38872 9.65238 12.1116 4.88386 7.77553 10.7796 numMergedOcc 0
13 mol 238 unq 0 iso 0 dist 9.3099 8.85202 10.7363 15.4987 8.54425 16.1459 numMergedOcc 0
14 mol 238 unq 1 iso 0 dist 9.3099 6.97527 10.3147 15.4987 8.54425 14.4206 numMergedOcc 0
15 mol 260 unq 0 iso 0 dist 6.29389 4.76698 4.73121 3.43932 5.30187 4.52405 numMergedOcc 0
16 mol 274 unq 0 iso 0 dist 8.38395 6.74022 4.60275 3.47588 9.85661 8.09181 numMergedOcc 0
17 mol 277 unq 0 iso 0 dist 9.28545 7.64361 5.7252 7.69413 8.13595 6.23115 numMergedOcc 0
18 mol 281 unq 0 iso 0 dist 9.26654 9.42297 14.9634 7.60311 9.94612 6.18742 numMergedOcc 0
