0 mol 26 unq 0 iso 0 dist 8.06656 8.01238 5.45023 6.84751 4.39827 5.39199 numMergedOcc 0
1 mol 30 unq 0 iso 0 dist 5.82247 5.22453 5.60789 8.59794 10.2588 5.67846 numMergedOcc 0
2 mol 30 unq 1 iso 0 dist 7.28907 5.73475 5.60789 9.16278 4.60505 5.0755 numMergedOcc 0
3 mol 85 unq 0 iso 0 dist 8.64047 5.99046 8.31077 6.24296 12.7386 11.0952 numMergedOcc 0
4 mol 85 unq 1 iso 0 dist 8.64047 5.99046 8.31077 6.83218 14.1999 12.5181 numMergedOcc 0
5 mol 93 unq 0 iso 0 dist 8.21739 6.70158 14.0508 9.43355 4.97727 14.433 numMergedOcc 0
6 mol 93 unq 1 iso 0 dist 8.21739 6.70158 14.0508 5.64141 5.77343 9.54244 numMergedOcc 0
7 mol 93 unq 2 iso 0 dist 8.21739 6.70158 14.0508 5.46186 11.0802 9.86691 numMergedOcc 0
8 mol 93 unq 3 iso 0 dist 8.21739 7.29701 11.4196 9.43355 4.97727 14.9656 numMergedOcc 0
9 mol 93 unq 4 iso 0 dist 8.21739 7.29701 11.4196 5.64141 5.77343 11.5397 numMergedOcc 0
10 mol 93 unq 5 iso 0 dist 8.21739 7.29701 11.4196 5.46186 11.0802 5.43515 numMergedOcc 0
11 mol 93 unq 6 iso 0 dist 4.78377 6.70158 5.25485 9.43355 13.8087 14.433 numMergedOcc 0
12 mol 93 unq 7 iso 0 dist 4.78377 6.70158 5.25485 5.64141 9.96831 9.54244 numMergedOcc 0
13 mol 93 unq 8 iso 0 dist 4.78377 6.70158 5.25485 5.46186 5.33894 9.86691 numMergedOcc 0
14 mol 93 unq 9 iso 0 dist 4.78377 7.29701 8.05783 9.43355 13.8087 14.9656 numMergedOcc 0
15 mol 93 unq 10 iso 0 dist 4.78377 7.29701 8.05783 5.64141 9.96831 11.5397 numMergedOcc 0
16 mol 93 unq 11 iso 0 dist 4.78377 7.29701 8.05783 5.46186 5.33894 5.43515 numMergedOcc 0
17 mol 173 unq 0 iso 0 dist 9.476 6.07708 9.45432 5.82174 6.38538 4.60149 numMergedOcc 0
18 mol 173 unq 1 iso 0 dist 5.77288 6.07708 11.4153 5.82174 9.14584 4.60149 numMergedOcc 0
19 mol 186 unq 0 iso 0 dist 8.78339 7.77211 11.3044 9.22792 16.6117 8.65911 numMergedOcc 0
20 mol 186 unq 1 iso 0 dist 8.78339 7.77211 11.3044 7.85696 12.8276 5.48935 numMergedOcc 0
21 mol 186 unq 2 iso 0 dist 8.78339 7.77211 11.3044 5.00402 10.9737 3.87082 numMergedOcc 0
22 mol 186 unq 3 iso 0 dist 8.78339 7.77211 11.3044 6.17773 7.02093 5.94181 numMergedOcc 0
23 mol 266 unq 0 iso 0 dist 7.92391 5.62193 8.62248 9.1946 7.38812 6.47745 numMergedOcc 0
24 mol 287 unq 0 iso 0 dist 6.69569 8.58448 5.03509 9.98518 13.2109 11.1883 numMergedOcc 0
25 mol 288 unq 0 iso 0 dist 6.69569 8.58448 5.03509 9.98518 13.2109 11.1883 numMergedOcc 0
26 mol 289 unq 0 iso 0 dist 6.69569 8.58448 5.03509 9.98518 13.2109 11.1883 numMergedOcc 0
