0 mol 1 unq 0 iso 0 dist 9.72447 12.0811 5.74199 11.3067 7.28542 7.68226 numMergedOcc 0
1 mol 54 unq 0 iso 0 dist 8.53459 5.83259 6.79881 10.2461 5.29182 8.80745 numMergedOcc 0
2 mol 73 unq 0 iso 0 dist 7.37476 6.28936 5.92936 13.1686 8.57639 7.75341 numMergedOcc 0
3 mol 76 unq 0 iso 0 dist 7.52544 6.1691 7.02854 10.1464 5.69691 8.5069 numMergedOcc 0
4 mol 90 unq 0 iso 0 dist 8.60438 4.77259 6.6146 7.15918 6.55381 8.48639 numMergedOcc 0
5 mol 91 unq 0 iso 0 dist 5.22576 5.05933 5.78962 9.27894 5.09341 7.77953 numMergedOcc 0
6 mol 91 unq 1 iso 0 dist 8.65409 10.592 5.78962 13.7163 5.09341 7.77953 numMergedOcc 0
7 mol 130 unq 0 iso 0 dist 9.9205 5.23471 8.50054 12.6212 9.23498 9.88678 numMergedOcc 0
8 mol 130 unq 1 iso 0 dist 9.9205 10.647 7.47653 12.6212 9.23498 7.06547 numMergedOcc 0
9 mol 143 unq 0 iso 0 dist 9.6112 13.4643 6.68364 13.4835 5.88056 5.44814 numMergedOcc 0
10 mol 148 unq 0 iso 0 dist 6.17633 9.59882 9.71692 11.802 8.01366 8.3656 numMergedOcc 0
11 mol 148 unq 1 iso 0 dist 9.32264 9.435 9.71692 12.1554 8.01366 8.3656 numMergedOcc 0
12 mol 150 unq 0 iso 0 dist 6.20295 9.57563 9.73708 11.8793 8.04136 8.44633 numMergedOcc 0
13 mol 150 unq 1 iso 0 dist 9.34249 9.39127 9.73708 12.1567 8.04136 8.44633 numMergedOcc 0
14 mol 183 unq 0 iso 0 dist 7.23572 8.49147 7.94469 11.9447 5.62792 8.51612 numMergedOcc 0
15 mol 214 unq 0 iso 0 dist 8.67902 8.50143 7.25293 10.8214 4.47554 5.79617 numMergedOcc 0
16 mol 218 unq 0 iso 0 dist 6.35646 5.01938 4.61671 9.56615 8.06186 8.38813 numMergedOcc 0
17 mol 218 unq 1 iso 0 dist 5.59354 5.01938 8.44004 9.56615 7.45028 8.38813 numMergedOcc 0
18 mol 266 unq 0 iso 0 dist 8.78501 12.4808 8.12204 8.6959 5.85295 9.97206 numMergedOcc 0
19 mol 277 unq 0 iso 0 dist 9.60879 9.93994 6.23539 8.20902 5.38166 8.18813 numMergedOcc 0
20 mol 279 unq 0 iso 0 dist 6.08524 9.39342 7.2783 10.0414 6.83947 9.67649 numMergedOcc 0
21 mol 279 unq 1 iso 0 dist 8.9885 10.4605 7.2783 15.4884 6.83947 9.67649 numMergedOcc 0
22 mol 279 unq 2 iso 0 dist 9.72665 4.80106 9.98985 8.93379 7.38256 5.60922 numMergedOcc 0
