0 mol 46 unq 0 iso 0 dist 6.35731 7.12713 3.57198 4.64633 5.53419 3.77542 numMergedOcc 0
1 mol 53 unq 0 iso 0 dist 6.81867 7.03969 5.80365 4.54851 8.19958 8.88512 numMergedOcc 0
2 mol 93 unq 0 iso 0 dist 8.6701 8.345 12.3169 7.0652 5.56839 11.0789 numMergedOcc 0
3 mol 93 unq 1 iso 0 dist 8.6701 6.06155 9.11323 7.0652 5.56839 8.71366 numMergedOcc 0
4 mol 93 unq 2 iso 0 dist 6.85457 8.345 11.9244 7.0652 7.83506 11.0789 numMergedOcc 0
5 mol 93 unq 3 iso 0 dist 6.85457 6.06155 8.52329 7.0652 7.83506 8.71366 numMergedOcc 0
6 mol 103 unq 0 iso 0 dist 6.37224 7.91691 9.33661 7.6171 5.51053 12.0557 numMergedOcc 0
7 mol 107 unq 0 iso 0 dist 8.92347 4.99934 8.49625 4.34186 7.89505 8.19484 numMergedOcc 0
8 mol 113 unq 0 iso 0 dist 5.7085 6.38269 6.29259 10.3017 7.40338 5.31126 numMergedOcc 0
9 mol 113 unq 1 iso 0 dist 5.7085 7.11196 7.08122 10.3017 7.40338 7.16619 numMergedOcc 0
10 mol 123 unq 0 iso 0 dist 8.29394 7.49032 4.10526 5.04742 9.42762 8.78115 numMergedOcc 0
11 mol 123 unq 1 iso 0 dist 8.29394 7.49032 4.10526 11.4019 7.30244 8.03692 numMergedOcc 0
12 mol 123 unq 2 iso 0 dist 5.98534 7.04627 4.10526 5.02162 9.42762 8.78115 numMergedOcc 0
13 mol 123 unq 3 iso 0 dist 5.98534 7.04627 4.10526 8.90549 7.30244 8.03692 numMergedOcc 0
14 mol 168 unq 0 iso 0 dist 8.80059 8.47439 3.73181 4.18108 6.12453 5.28353 numMergedOcc 0
15 mol 168 unq 1 iso 0 dist 8.80059 8.47439 3.73181 3.6038 9.87447 10.3204 numMergedOcc 0
16 mol 194 unq 0 iso 0 dist 7.27978 9.3032 3.7326 12.2934 8.43182 5.10542 numMergedOcc 0
17 mol 258 unq 0 iso 0 dist 7.41653 8.86773 13.163 3.57554 9.36974 11.7603 numMergedOcc 0
18 mol 258 unq 1 iso 0 dist 7.41653 8.95095 14.0247 3.57554 9.36974 9.53717 numMergedOcc 0
