0 mol 20 unq 0 iso 0 dist 7.61139 4.8515 7.99756 11.9804 13.1875 9.38691 numMergedOcc 0
1 mol 20 unq 1 iso 0 dist 7.61139 4.8515 7.99756 11.4453 14.6805 8.65986 numMergedOcc 0
2 mol 20 unq 2 iso 0 dist 7.61139 4.8515 7.99756 10.7849 15.502 9.74724 numMergedOcc 0
3 mol 20 unq 3 iso 0 dist 6.54552 4.8515 4.36087 11.9804 8.26217 9.38691 numMergedOcc 0
4 mol 20 unq 4 iso 0 dist 6.54552 4.8515 4.36087 11.4453 9.51548 8.65986 numMergedOcc 0
5 mol 20 unq 5 iso 0 dist 6.54552 4.8515 4.36087 10.7849 10.9502 9.74724 numMergedOcc 0
6 mol 20 unq 6 iso 0 dist 6.54552 3.51645 7.09639 11.4453 9.51548 9.39462 numMergedOcc 0
7 mol 20 unq 7 iso 0 dist 6.54552 3.51645 7.09639 10.7849 10.9502 9.13347 numMergedOcc 0
8 mol 63 unq 0 iso 0 dist 8.77624 10.9354 8.78414 12.0623 3.3919 9.58748 numMergedOcc 0
9 mol 68 unq 0 iso 0 dist 6.37273 5.37935 8.19932 9.23087 5.69088 8.32093 numMergedOcc 0
10 mol 78 unq 0 iso 0 dist 9.6163 10.0772 9.80913 10.552 6.52581 8.70827 numMergedOcc 0
11 mol 78 unq 1 iso 0 dist 9.6163 10.0772 9.80913 6.40757 10.4812 9.86479 numMergedOcc 0
12 mol 116 unq 0 iso 0 dist 9.63281 5.21959 9.87354 8.07119 4.13685 7.39112 numMergedOcc 0
13 mol 141 unq 0 iso 0 dist 7.11411 3.82773 5.95801 6.48738 4.34041 4.70342 numMergedOcc 0
14 mol 141 unq 1 iso 0 dist 7.11411 9.09917 9.92715 6.48738 4.34041 8.23543 numMergedOcc 0
15 mol 217 unq 0 iso 0 dist 8.46235 8.92326 6.19602 12.7881 4.38808 9.04156 numMergedOcc 0
16 mol 217 unq 1 iso 0 dist 5.27487 4.90493 6.19602 7.01604 4.38808 9.04156 numMergedOcc 0
17 mol 222 unq 0 iso 0 dist 5.07975 12.2754 8.88902 15.0803 10.308 8.47836 numMergedOcc 0
18 mol 252 unq 0 iso 0 dist 4.54745 8.56684 9.81261 10.1823 9.49612 8.63893 numMergedOcc 0
19 mol 282 unq 0 iso 0 dist 9.33418 8.24765 9.06947 11.6436 6.3041 7.89625 numMergedOcc 0
