0 mol 62 unq 0 iso 0 dist 8.45469 10.035 9.27092 3.89181 6.58981 6.8858 numMergedOcc 0
1 mol 62 unq 1 iso 0 dist 5.48766 4.94224 6.56664 5.4275 9.1926 9.17877 numMergedOcc 0
2 mol 62 unq 2 iso 0 dist 5.48766 11.7123 9.58156 5.4275 9.1926 13.7909 numMergedOcc 0
3 mol 90 unq 0 iso 0 dist 9.24651 9.74415 4.75701 6.8994 6.02596 4.79453 numMergedOcc 0
4 mol 90 unq 1 iso 0 dist 4.5401 9.74415 9.89618 6.8994 8.17454 4.79453 numMergedOcc 0
5 mol 95 unq 0 iso 0 dist 8.98691 7.08612 8.27456 13.5194 9.98215 17.0418 numMergedOcc 0
6 mol 96 unq 0 iso 0 dist 8.36933 12.5479 6.19867 13.8839 7.22615 6.08084 numMergedOcc 0
7 mol 96 unq 1 iso 0 dist 6.55474 10.7784 8.35452 4.47037 6.02608 11.6473 numMergedOcc 0
8 mol 96 unq 2 iso 0 dist 6.64899 5.82685 8.35452 8.85827 6.02608 11.6473 numMergedOcc 0
9 mol 96 unq 3 iso 0 dist 8.02307 5.3958 8.35452 12.4117 6.02608 11.6473 numMergedOcc 0
10 mol 96 unq 4 iso 0 dist 6.68473 6.48746 6.19867 3.92234 7.22615 6.08084 numMergedOcc 0
11 mol 110 unq 0 iso 0 dist 7.03608 4.31022 7.2461 8.60792 7.59747 6.79448 numMergedOcc 0
12 mol 110 unq 1 iso 0 dist 7.03608 7.33518 9.26333 8.60792 7.59747 3.80114 numMergedOcc 0
13 mol 117 unq 0 iso 0 dist 6.98104 13.0727 9.60425 10.2106 5.94465 11.1642 numMergedOcc 0
14 mol 129 unq 0 iso 0 dist 5.51129 7.86921 7.00798 8.90391 8.42277 12.7464 numMergedOcc 0
15 mol 129 unq 1 iso 0 dist 5.51129 7.86921 7.00798 5.85476 6.26653 10.1964 numMergedOcc 0
16 mol 146 unq 0 iso 0 dist 8.64781 7.02519 8.53451 5.64529 8.91908 5.34214 numMergedOcc 0
17 mol 146 unq 1 iso 0 dist 8.64781 7.05046 7.24965 5.64529 8.91908 9.58921 numMergedOcc 0
18 mol 210 unq 0 iso 0 dist 6.8631 13.0116 7.86668 9.59663 8.20259 9.97638 numMergedOcc 0
19 mol 220 unq 0 iso 0 dist 7.00531 4.8193 5.71825 6.47265 6.23243 3.57917 numMergedOcc 0
20 mol 264 unq 0 iso 0 dist 6.14231 6.9758 9.00498 11.3526 6.67548 10.4585 numMergedOcc 0
21 mol 264 unq 1 iso 0 dist 6.14231 6.9758 9.00498 8.93485 5.57579 8.25406 numMergedOcc 0
22 mol 264 unq 2 iso 0 dist 4.68488 5.00433 9.00498 6.26054 6.67548 10.4585 numMergedOcc 0
23 mol 264 unq 3 iso 0 dist 4.68488 5.00433 9.00498 3.81537 5.57579 8.25406 numMergedOcc 0
24 mol 281 unq 0 iso 0 dist 9.79394 6.83107 7.04661 16.2332 7.43535 12.8596 numMergedOcc 0
25 mol 281 unq 1 iso 0 dist 6.52115 5.22248 7.04661 12.9503 7.43535 12.8596 numMergedOcc 0
