0 mol 10 unq 0 iso 0 dist 8.03458 9.03951 11.04 9.93084 13.6478 6.18431 numMergedOcc 0
1 mol 10 unq 1 iso 0 dist 8.03458 9.03951 11.04 5.10227 12.2752 9.07726 numMergedOcc 0
2 mol 10 unq 2 iso 0 dist 8.2106 9.03951 9.13852 9.93084 13.875 6.18431 numMergedOcc 0
3 mol 10 unq 3 iso 0 dist 8.2106 9.03951 9.13852 5.10227 11.4409 9.07726 numMergedOcc 0
4 mol 24 unq 0 iso 0 dist 9.22152 7.06532 10.658 5.42563 14.6153 9.33304 numMergedOcc 0
5 mol 24 unq 1 iso 0 dist 9.22152 7.06532 10.658 6.87351 13.9066 4.5711 numMergedOcc 0
6 mol 24 unq 2 iso 0 dist 9.22152 7.06532 10.658 7.79018 13.3728 4.44526 numMergedOcc 0
7 mol 29 unq 0 iso 0 dist 5.36278 8.9204 7.29489 5.3571 9.78134 9.41017 numMergedOcc 0
8 mol 48 unq 0 iso 0 dist 9.53081 6.42242 5.84184 7.51675 11.8077 6.07052 numMergedOcc 0
9 mol 73 unq 0 iso 0 dist 8.90896 6.66506 5.00474 14.7163 11.6655 8.96616 numMergedOcc 0
10 mol 73 unq 1 iso 0 dist 8.90896 6.66506 5.00474 11.5216 9.79061 6.14542 numMergedOcc 0
11 mol 73 unq 2 iso 0 dist 7.58027 6.82707 12.5165 4.93697 10.2801 8.4701 numMergedOcc 0
12 mol 73 unq 3 iso 0 dist 4.34694 6.82707 10.5011 4.93697 7.47162 8.4701 numMergedOcc 0
13 mol 91 unq 0 iso 0 dist 8.91354 6.93893 5.06999 5.09341 9.84288 8.77355 numMergedOcc 0
14 mol 129 unq 0 iso 0 dist 9.52061 6.48695 7.95267 6.57177 13.9579 9.35533 numMergedOcc 0
15 mol 134 unq 0 iso 0 dist 9.88178 7.50264 13.5143 10.5179 15.0906 7.83568 numMergedOcc 0
16 mol 162 unq 0 iso 0 dist 6.59407 6.80226 4.93161 4.92282 9.44259 8.33407 numMergedOcc 0
17 mol 171 unq 0 iso 0 dist 6.19457 6.4751 9.13204 15.1472 17.9895 9.34834 numMergedOcc 0
18 mol 171 unq 1 iso 0 dist 6.19457 6.4751 9.13204 10.2839 12.557 5.74846 numMergedOcc 0
19 mol 195 unq 0 iso 0 dist 7.2833 9.25935 8.71774 4.79025 9.20541 6.22742 numMergedOcc 0
20 mol 232 unq 0 iso 0 dist 6.77822 9.25162 9.4234 12.9179 13.9307 6.59036 numMergedOcc 0
21 mol 239 unq 0 iso 0 dist 8.48545 6.91534 9.08479 3.28983 9.993 8.95511 numMergedOcc 0
22 mol 244 unq 0 iso 0 dist 7.43391 9.97458 16.3 8.65358 15.3887 6.53416 numMergedOcc 0
23 mol 244 unq 1 iso 0 dist 7.79787 9.97458 4.89551 8.65358 8.93589 6.53416 numMergedOcc 0
24 mol 258 unq 0 iso 0 dist 9.8165 8.51736 10.5286 7.23383 13.69 7.95464 numMergedOcc 0
25 mol 266 unq 0 iso 0 dist 8.8646 9.54381 14.5123 9.91008 18.5741 9.63518 numMergedOcc 0
26 mol 279 unq 0 iso 0 dist 8.03486 9.29922 15.4124 4.91802 8.34313 7.17958 numMergedOcc 0
