0 mol 41 unq 0 iso 0 dist 5.36895 10.7783 8.66014 6.85618 9.17982 8.23709 numMergedOcc 0
1 mol 41 unq 1 iso 0 dist 5.36895 10.7783 8.66014 8.25624 9.62869 13.5434 numMergedOcc 0
2 mol 41 unq 2 iso 0 dist 5.36895 10.7783 8.66014 5.36021 6.40219 6.26042 numMergedOcc 0
3 mol 72 unq 0 iso 0 dist 9.43143 6.9491 7.60252 10.2533 4.86198 8.5416 numMergedOcc 0
4 mol 109 unq 0 iso 0 dist 7.24527 6.64703 6.73551 4.61206 9.63963 5.5224 numMergedOcc 0
5 mol 122 unq 0 iso 0 dist 8.47907 4.23094 5.94669 12.1473 4.42563 8.69407 numMergedOcc 0
6 mol 154 unq 0 iso 0 dist 6.44195 11.6914 8.62155 5.71332 8.89394 15.5413 numMergedOcc 0
7 mol 196 unq 0 iso 0 dist 9.23836 17.5342 9.99721 6.17727 4.67869 12.5769 numMergedOcc 0
8 mol 197 unq 0 iso 0 dist 6.18446 9.01592 9.24777 9.33865 9.23086 5.78087 numMergedOcc 0
9 mol 231 unq 0 iso 0 dist 6.02527 8.02725 6.52115 11.6594 9.9868 4.16638 numMergedOcc 0
10 mol 231 unq 1 iso 0 dist 6.02527 8.02725 6.52115 7.54254 7.3268 9.07594 numMergedOcc 0
11 mol 231 unq 2 iso 0 dist 6.02527 6.48256 9.88437 11.6594 9.9868 16.412 numMergedOcc 0
12 mol 231 unq 3 iso 0 dist 6.02527 6.48256 9.88437 7.54254 7.3268 5.78736 numMergedOcc 0
13 mol 277 unq 0 iso 0 dist 7.23956 13.9612 8.61945 9.7252 4.9764 12.3675 numMergedOcc 0
14 mol 277 unq 1 iso 0 dist 7.23956 13.9612 8.61945 10.5201 6.36559 13.8357 numMergedOcc 0
15 mol 285 unq 0 iso 0 dist 9.82717 8.56772 9.25455 13.5711 6.71946 13.411 numMergedOcc 0
16 mol 285 unq 1 iso 0 dist 9.82717 8.56772 9.25455 17.9142 8.28061 14.396 numMergedOcc 0
17 mol 285 unq 2 iso 0 dist 9.82717 8.56772 9.25455 13.8352 5.03601 9.96845 numMergedOcc 0
18 mol 285 unq 3 iso 0 dist 8.33653 16.8132 9.25455 7.76515 6.71946 13.411 numMergedOcc 0
19 mol 285 unq 4 iso 0 dist 8.33653 16.8132 9.25455 5.12725 8.28061 14.396 numMergedOcc 0
20 mol 285 unq 5 iso 0 dist 8.33653 16.8132 9.25455 7.52611 5.03601 9.96845 numMergedOcc 0
21 mol 285 unq 6 iso 0 dist 6.44657 10.5523 9.25455 11.6832 6.71946 13.411 numMergedOcc 0
22 mol 285 unq 7 iso 0 dist 6.44657 10.5523 9.25455 6.73715 8.28061 14.396 numMergedOcc 0
23 mol 285 unq 8 iso 0 dist 6.44657 10.5523 9.25455 5.32175 5.03601 9.96845 numMergedOcc 0
